3-(cyclopropylmethyl)-N'-[1-[(3-naphthalen-2-ylphenyl)methyl]-2-oxidanylidene-azepan-3-yl]-2-prop-2-enyl-butanediamide

Systemtic Name: 3-(cyclopropylmethyl)-N'-[1-[(3-naphthalen-2-ylphenyl)methyl]-2-oxidanylidene-azepan-3-yl]-2-prop-2-enyl-butanediamide Openeye Name: 2-allyl-3-(cyclopropylmethyl)-N'-[1-[[3-(2-naphthyl)phenyl]methyl]-2-oxo-azepan-3-yl]butanediamide CAS Name: 3-(cyclopropylmethyl)-N'-[1-[[3-(2-naphthalenyl)phenyl]methyl]-2-oxo-3-azepanyl]-2-prop-2-enylbutanediamide IUPAC Name: 3-(cyclopropylmethyl)-N'-[1-[(3-naphthalen-2-ylphenyl)methyl]-2-oxoazepan-3-yl]-2-prop-2-enylbutanediamide Traditional Name: 2-allyl-3-(cyclopropylmethyl)-N'-[2-keto-1-[3-(2-naphthyl)benzyl]azepan-3-yl]succinamide Formula: C34H39N3O3 MolecularWeight: 537.69176

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCC(C(CC1CC1)C(=O)NC2CCCCN(C2=O)CC3=CC=CC(=C3)C4=CC5=CC=CC=C5C=C4)C(=O)N

Isomeric SMILES

C=CCC(C(CC1CC1)C(=O)NC2CCCCN(C2=O)CC3=CC=CC(=C3)C4=CC5=CC=CC=C5C=C4)C(=O)N

InChI

InChI=1S/C34H39N3O3/c1-2-8-29(32(35)38)30(20-23-14-15-23)33(39)36-31-13-5-6-18-37(34(31)40)22-24-9-7-12-26(19-24)28-17-16-25-10-3-4-11-27(25)21-28/h2-4,7,9-12,16-17,19,21,23,29-31H,1,5-6,8,13-15,18,20,22H2,(H2,35,38)(H,36,39)