3-(3,5-dimethoxyphenyl)-N-(2-oxidanylideneazepan-3-yl)-3-[1-(phenylmethyl)indol-3-yl]propanamide

Systemtic Name: 3-(3,5-dimethoxyphenyl)-N-(2-oxidanylideneazepan-3-yl)-3-[1-(phenylmethyl)indol-3-yl]propanamide Openeye Name: 3-(1-benzylindol-3-yl)-3-(3,5-dimethoxyphenyl)-N-(2-oxoazepan-3-yl)propanamide CAS Name: 3-(3,5-dimethoxyphenyl)-N-(2-oxo-3-azepanyl)-3-[1-(phenylmethyl)-3-indolyl]propanamide IUPAC Name: 3-(1-benzylindol-3-yl)-3-(3,5-dimethoxyphenyl)-N-(2-oxoazepan-3-yl)propanamide Traditional Name: 3-(1-benzylindol-3-yl)-3-(3,5-dimethoxyphenyl)-N-(2-ketoazepan-3-yl)propionamide Formula: C32H35N3O4 MolecularWeight: 525.638

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)C(CC(=O)NC2CCCCNC2=O)C3=CN(C4=CC=CC=C43)CC5=CC=CC=C5)OC

Isomeric SMILES

COC1=CC(=CC(=C1)C(CC(=O)NC2CCCCNC2=O)C3=CN(C4=CC=CC=C43)CC5=CC=CC=C5)OC

InChI

InChI=1S/C32H35N3O4/c1-38-24-16-23(17-25(18-24)39-2)27(19-31(36)34-29-13-8-9-15-33-32(29)37)28-21-35(20-22-10-4-3-5-11-22)30-14-7-6-12-26(28)30/h3-7,10-12,14,16-18,21,27,29H,8-9,13,15,19-20H2,1-2H3,(H,33,37)(H,34,36)