N-[2-(azepan-1-ylcarbonyl)phenyl]-1-[(3,4-dichlorophenyl)methyl]piperidine-4-carboxamide

Systemtic Name: N-[2-(azepan-1-ylcarbonyl)phenyl]-1-[(3,4-dichlorophenyl)methyl]piperidine-4-carboxamide Openeye Name: N-[2-(azepane-1-carbonyl)phenyl]-1-[(3,4-dichlorophenyl)methyl]piperidine-4-carboxamide CAS Name: N-[2-[1-azepanyl(oxo)methyl]phenyl]-1-[(3,4-dichlorophenyl)methyl]-4-piperidinecarboxamide IUPAC Name: N-[2-(azepane-1-carbonyl)phenyl]-1-[(3,4-dichlorophenyl)methyl]piperidine-4-carboxamide Traditional Name: N-[2-(azepane-1-carbonyl)phenyl]-1-(3,4-dichlorobenzyl)isonipecotamide Formula: C26H31Cl2N3O2 MolecularWeight: 488.44924

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2=CC=CC=C2NC(=O)C3CCN(CC3)CC4=CC(=C(C=C4)Cl)Cl

Isomeric SMILES

C1CCCN(CC1)C(=O)C2=CC=CC=C2NC(=O)C3CCN(CC3)CC4=CC(=C(C=C4)Cl)Cl

InChI

InChI=1S/C26H31Cl2N3O2/c27-22-10-9-19(17-23(22)28)18-30-15-11-20(12-16-30)25(32)29-24-8-4-3-7-21(24)26(33)31-13-5-1-2-6-14-31/h3-4,7-10,17,20H,1-2,5-6,11-16,18H2,(H,29,32)