N-(4-azanylcyclohexyl)-N-[[2-[(4-cyanophenyl)carbonylamino]phenyl]methyl]-3,4-dimethoxy-benzamide

Systemtic Name: N-(4-azanylcyclohexyl)-N-[[2-[(4-cyanophenyl)carbonylamino]phenyl]methyl]-3,4-dimethoxy-benzamide Openeye Name: N-(4-aminocyclohexyl)-N-[[2-[(4-cyanobenzoyl)amino]phenyl]methyl]-3,4-dimethoxy-benzamide CAS Name: N-(4-aminocyclohexyl)-N-[[2-[[(4-cyanophenyl)-oxomethyl]amino]phenyl]methyl]-3,4-dimethoxybenzamide IUPAC Name: N-(4-aminocyclohexyl)-N-[[2-[(4-cyanobenzoyl)amino]phenyl]methyl]-3,4-dimethoxybenzamide Traditional Name: N-(4-aminocyclohexyl)-N-[2-[(4-cyanobenzoyl)amino]benzyl]-3,4-dimethoxy-benzamide Formula: C30H32N4O4 MolecularWeight: 512.59948

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)N(CC2=CC=CC=C2NC(=O)C3=CC=C(C=C3)C#N)C4CCC(CC4)N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)N(CC2=CC=CC=C2NC(=O)C3=CC=C(C=C3)C#N)C4CCC(CC4)N)OC

InChI

InChI=1S/C30H32N4O4/c1-37-27-16-11-22(17-28(27)38-2)30(36)34(25-14-12-24(32)13-15-25)19-23-5-3-4-6-26(23)33-29(35)21-9-7-20(18-31)8-10-21/h3-11,16-17,24-25H,12-15,19,32H2,1-2H3,(H,33,35)