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

Systemtic Name: 2-butyl-3-(cyclopentylmethyl)-N'-[2-oxidanylidene-1-[3-(phenylcarbonyl)phenyl]azepan-3-yl]butanediamide Openeye Name: N'-[1-(3-benzoylphenyl)-2-oxo-azepan-3-yl]-2-butyl-3-(cyclopentylmethyl)butanediamide CAS Name: N'-[1-(3-benzoylphenyl)-2-oxo-3-azepanyl]-2-butyl-3-(cyclopentylmethyl)butanediamide IUPAC Name: N'-[1-(3-benzoylphenyl)-2-oxoazepan-3-yl]-2-butyl-3-(cyclopentylmethyl)butanediamide Traditional Name: N'-[1-(3-benzoylphenyl)-2-keto-azepan-3-yl]-2-butyl-3-(cyclopentylmethyl)succinamide Formula: C33H43N3O4 MolecularWeight: 545.71222

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C33H43N3O4/c1-2-3-18-27(31(34)38)28(21-23-12-7-8-13-23)32(39)35-29-19-9-10-20-36(33(29)40)26-17-11-16-25(22-26)30(37)24-14-5-4-6-15-24/h4-6,11,14-17,22-23,27-29H,2-3,7-10,12-13,18-21H2,1H3,(H2,34,38)(H,35,39)