N-(4-azanylcyclohexyl)-3-benzamido-4-[4-(3,4-dimethoxyphenyl)carbonyl-1,4-diazepan-1-yl]benzamide

Systemtic Name: N-(4-azanylcyclohexyl)-3-benzamido-4-[4-(3,4-dimethoxyphenyl)carbonyl-1,4-diazepan-1-yl]benzamide Openeye Name: N-(4-aminocyclohexyl)-3-benzamido-4-[4-(3,4-dimethoxybenzoyl)-1,4-diazepan-1-yl]benzamide CAS Name: N-(4-aminocyclohexyl)-3-benzamido-4-[4-[(3,4-dimethoxyphenyl)-oxomethyl]-1,4-diazepan-1-yl]benzamide IUPAC Name: N-(4-aminocyclohexyl)-3-benzamido-4-[4-(3,4-dimethoxybenzoyl)-1,4-diazepan-1-yl]benzamide Traditional Name: N-(4-aminocyclohexyl)-3-benzamido-4-(4-veratroyl-1,4-diazepan-1-yl)benzamide Formula: C34H41N5O5 MolecularWeight: 599.71984

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)N2CCCN(CC2)C3=C(C=C(C=C3)C(=O)NC4CCC(CC4)N)NC(=O)C5=CC=CC=C5)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)N2CCCN(CC2)C3=C(C=C(C=C3)C(=O)NC4CCC(CC4)N)NC(=O)C5=CC=CC=C5)OC

InChI

InChI=1S/C34H41N5O5/c1-43-30-16-10-25(22-31(30)44-2)34(42)39-18-6-17-38(19-20-39)29-15-9-24(33(41)36-27-13-11-26(35)12-14-27)21-28(29)37-32(40)23-7-4-3-5-8-23/h3-5,7-10,15-16,21-22,26-27H,6,11-14,17-20,35H2,1-2H3,(H,36,41)(H,37,40)