N-[2-[[(4-azanylcyclohexyl)-(4-cyanophenyl)carbonyl-amino]methyl]phenyl]-3-methoxy-benzamide

Systemtic Name: N-[2-[[(4-azanylcyclohexyl)-(4-cyanophenyl)carbonyl-amino]methyl]phenyl]-3-methoxy-benzamide Openeye Name: N-[2-[[(4-aminocyclohexyl)-(4-cyanobenzoyl)amino]methyl]phenyl]-3-methoxy-benzamide CAS Name: N-[2-[[(4-aminocyclohexyl)-[(4-cyanophenyl)-oxomethyl]amino]methyl]phenyl]-3-methoxybenzamide IUPAC Name: N-[2-[[(4-aminocyclohexyl)-(4-cyanobenzoyl)amino]methyl]phenyl]-3-methoxybenzamide Traditional Name: N-[2-[[(4-aminocyclohexyl)-(4-cyanobenzoyl)amino]methyl]phenyl]-3-methoxy-benzamide Formula: C29H30N4O3 MolecularWeight: 482.5735

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=O)NC2=CC=CC=C2CN(C3CCC(CC3)N)C(=O)C4=CC=C(C=C4)C#N

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)NC2=CC=CC=C2CN(C3CCC(CC3)N)C(=O)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C29H30N4O3/c1-36-26-7-4-6-22(17-26)28(34)32-27-8-3-2-5-23(27)19-33(25-15-13-24(31)14-16-25)29(35)21-11-9-20(18-30)10-12-21/h2-12,17,24-25H,13-16,19,31H2,1H3,(H,32,34)