1-[1-[(2-chlorophenyl)methyl]-7-oxidanylidene-azepan-4-yl]-N,N-diethyl-piperidine-3-carboxamide

Systemtic Name: 1-[1-[(2-chlorophenyl)methyl]-7-oxidanylidene-azepan-4-yl]-N,N-diethyl-piperidine-3-carboxamide Openeye Name: 1-[1-[(2-chlorophenyl)methyl]-7-oxo-azepan-4-yl]-N,N-diethyl-piperidine-3-carboxamide CAS Name: 1-[1-[(2-chlorophenyl)methyl]-7-oxo-4-azepanyl]-N,N-diethyl-3-piperidinecarboxamide IUPAC Name: 1-[1-[(2-chlorophenyl)methyl]-7-oxoazepan-4-yl]-N,N-diethylpiperidine-3-carboxamide Traditional Name: 1-[1-(2-chlorobenzyl)-7-keto-azepan-4-yl]-N,N-diethyl-nipecotamide Formula: C23H34ClN3O2 MolecularWeight: 419.98796

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1CCCN(C1)C2CCC(=O)N(CC2)CC3=CC=CC=C3Cl

Isomeric SMILES

CCN(CC)C(=O)C1CCCN(C1)C2CCC(=O)N(CC2)CC3=CC=CC=C3Cl

InChI

InChI=1S/C23H34ClN3O2/c1-3-25(4-2)23(29)19-9-7-14-26(17-19)20-11-12-22(28)27(15-13-20)16-18-8-5-6-10-21(18)24/h5-6,8,10,19-20H,3-4,7,9,11-17H2,1-2H3