(3S)-N,N-diethyl-1-[(4S)-1-[(4-methylphenyl)methyl]-7-oxidanylidene-azepan-4-yl]piperidine-3-carboxamide

Systemtic Name: (3S)-N,N-diethyl-1-[(4S)-1-[(4-methylphenyl)methyl]-7-oxidanylidene-azepan-4-yl]piperidine-3-carboxamide Openeye Name: (3S)-N,N-diethyl-1-[(4S)-7-oxo-1-(p-tolylmethyl)azepan-4-yl]piperidine-3-carboxamide CAS Name: (3S)-N,N-diethyl-1-[(4S)-1-[(4-methylphenyl)methyl]-7-oxo-4-azepanyl]-3-piperidinecarboxamide IUPAC Name: (3S)-N,N-diethyl-1-[(4S)-1-[(4-methylphenyl)methyl]-7-oxoazepan-4-yl]piperidine-3-carboxamide Traditional Name: (3S)-N,N-diethyl-1-[(4S)-7-keto-1-(4-methylbenzyl)azepan-4-yl]nipecotamide Formula: C24H37N3O2 MolecularWeight: 399.56948

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1CCCN(C1)C2CCC(=O)N(CC2)CC3=CC=C(C=C3)C

Isomeric SMILES

CCN(CC)C(=O)[C@H]1CCCN(C1)[C@H]2CCC(=O)N(CC2)CC3=CC=C(C=C3)C

InChI

InChI=1S/C24H37N3O2/c1-4-25(5-2)24(29)21-7-6-15-26(18-21)22-12-13-23(28)27(16-14-22)17-20-10-8-19(3)9-11-20/h8-11,21-22H,4-7,12-18H2,1-3H3/t21-,22-/m0/s1