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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)N(CC2=CC(=CC=C2)NC(=O)C3=CC=C(C=C3)C#N)C4CCCCC4N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)N(CC2=CC(=CC=C2)NC(=O)C3=CC=C(C=C3)C#N)C4CCCCC4N)OC

InChI

InChI=1S/C30H32N4O4/c1-37-27-15-14-23(17-28(27)38-2)30(36)34(26-9-4-3-8-25(26)32)19-21-6-5-7-24(16-21)33-29(35)22-12-10-20(18-31)11-13-22/h5-7,10-17,25-26H,3-4,8-9,19,32H2,1-2H3,(H,33,35)