3-(cyclopentylmethyl)-N'-[1-[(3-naphthalen-2-ylphenyl)methyl]-2-oxidanylidene-azepan-3-yl]-2-propyl-butanediamide

Systemtic Name: 3-(cyclopentylmethyl)-N'-[1-[(3-naphthalen-2-ylphenyl)methyl]-2-oxidanylidene-azepan-3-yl]-2-propyl-butanediamide Openeye Name: 3-(cyclopentylmethyl)-N'-[1-[[3-(2-naphthyl)phenyl]methyl]-2-oxo-azepan-3-yl]-2-propyl-butanediamide CAS Name: 3-(cyclopentylmethyl)-N'-[1-[[3-(2-naphthalenyl)phenyl]methyl]-2-oxo-3-azepanyl]-2-propylbutanediamide IUPAC Name: 3-(cyclopentylmethyl)-N'-[1-[(3-naphthalen-2-ylphenyl)methyl]-2-oxoazepan-3-yl]-2-propylbutanediamide Traditional Name: 3-(cyclopentylmethyl)-N'-[2-keto-1-[3-(2-naphthyl)benzyl]azepan-3-yl]-2-propyl-succinamide Formula: C36H45N3O3 MolecularWeight: 567.7608

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(CC1CCCC1)C(=O)NC2CCCCN(C2=O)CC3=CC=CC(=C3)C4=CC5=CC=CC=C5C=C4)C(=O)N

Isomeric SMILES

CCCC(C(CC1CCCC1)C(=O)NC2CCCCN(C2=O)CC3=CC=CC(=C3)C4=CC5=CC=CC=C5C=C4)C(=O)N

InChI

InChI=1S/C36H45N3O3/c1-2-10-31(34(37)40)32(22-25-11-3-4-12-25)35(41)38-33-17-7-8-20-39(36(33)42)24-26-13-9-16-28(21-26)30-19-18-27-14-5-6-15-29(27)23-30/h5-6,9,13-16,18-19,21,23,25,31-33H,2-4,7-8,10-12,17,20,22,24H2,1H3,(H2,37,40)(H,38,41)