3-(cyclopentylmethyl)-N'-[2-oxidanylidene-1-[3-(phenylcarbonyl)phenyl]azepan-3-yl]-2-prop-2-enyl-butanediamide

Systemtic Name: 3-(cyclopentylmethyl)-N'-[2-oxidanylidene-1-[3-(phenylcarbonyl)phenyl]azepan-3-yl]-2-prop-2-enyl-butanediamide Openeye Name: 2-allyl-N'-[1-(3-benzoylphenyl)-2-oxo-azepan-3-yl]-3-(cyclopentylmethyl)butanediamide CAS Name: N'-[1-(3-benzoylphenyl)-2-oxo-3-azepanyl]-3-(cyclopentylmethyl)-2-prop-2-enylbutanediamide IUPAC Name: N'-[1-(3-benzoylphenyl)-2-oxoazepan-3-yl]-3-(cyclopentylmethyl)-2-prop-2-enylbutanediamide Traditional Name: 2-allyl-N'-[1-(3-benzoylphenyl)-2-keto-azepan-3-yl]-3-(cyclopentylmethyl)succinamide Formula: C32H39N3O4 MolecularWeight: 529.66976

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCC(C(CC1CCCC1)C(=O)NC2CCCCN(C2=O)C3=CC=CC(=C3)C(=O)C4=CC=CC=C4)C(=O)N

Isomeric SMILES

C=CCC(C(CC1CCCC1)C(=O)NC2CCCCN(C2=O)C3=CC=CC(=C3)C(=O)C4=CC=CC=C4)C(=O)N

InChI

InChI=1S/C32H39N3O4/c1-2-11-26(30(33)37)27(20-22-12-6-7-13-22)31(38)34-28-18-8-9-19-35(32(28)39)25-17-10-16-24(21-25)29(36)23-14-4-3-5-15-23/h2-5,10,14-17,21-22,26-28H,1,6-9,11-13,18-20H2,(H2,33,37)(H,34,38)