AA73507
1454-53-1 | 1-Benzyl-3-carbethoxy-4-piperidone, HCl
Manufacturer: A2B Chem
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CatalogNumber
AA73507
ChemicalName
1-Benzyl-3-carbethoxy-4-piperidone, HCl
CasNumber
1454-53-1
MolecularFormula
C15H20ClNO3
MolecularWeight
297.7772
MdlNumber
MFCD01861280
Smiles
CCOC(=O)C1CN(CCC1=O)Cc1ccccc1.Cl
NscNumber
15156
Complexity
323
Covalently-bondedUnitCount
2
HeavyAtomCount
20
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
5
UndefinedAtomStereocenterCount
1
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CatalogNumber: AA73507
ChemicalName: 1-Benzyl-3-carbethoxy-4-piperidone, HCl
CasNumber: 1454-53-1
MolecularFormula: C15H20ClNO3
MolecularWeight: 297.7772
MdlNumber: MFCD01861280
Smiles: CCOC(=O)C1CN(CCC1=O)Cc1ccccc1.Cl
NscNumber: 15156
Complexity: 323
Covalently-bondedUnitCount: 2
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 5
UndefinedAtomStereocenterCount: 1
CatalogNumber:
AA73507
ChemicalName:
1-Benzyl-3-carbethoxy-4-piperidone, HCl
CasNumber:
1454-53-1
MolecularFormula:
C15H20ClNO3
MolecularWeight:
297.7772
MdlNumber:
MFCD01861280
Smiles:
CCOC(=O)C1CN(CCC1=O)Cc1ccccc1.Cl
NscNumber:
15156
Complexity:
323
Covalently-bondedUnitCount:
2
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
5
UndefinedAtomStereocenterCount:
1
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Smiles: CNC(=O)c1ccc(c(c1)C)NC(=O)OC(C)(C)C
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CNC(=O)c1ccc(c(c1)C)NC(=O)OC(C)(C)C
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Smiles: Cc1cc(Cc2cc(C)c(cc2C)O)c(c(c1)Cc1cc(C)c(cc1C)O)O
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Cc1cc(Cc2cc(C)c(cc2C)O)c(c(c1)Cc1cc(C)c(cc1C)O)O
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Smiles: [O-][N+](=O)c1cc(I)c(cc1F)F
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Smiles:
[O-][N+](=O)c1cc(I)c(cc1F)F
NscNumber:
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Complexity:
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Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
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