N-[2-[[[3-(aminomethyl)phenyl]methyl-cyclohexylcarbonyl-amino]methyl]phenyl]-3,4-dimethoxy-benzamide

Systemtic Name: N-[2-[[[3-(aminomethyl)phenyl]methyl-cyclohexylcarbonyl-amino]methyl]phenyl]-3,4-dimethoxy-benzamide Openeye Name: N-[2-[[[3-(aminomethyl)phenyl]methyl-(cyclohexanecarbonyl)amino]methyl]phenyl]-3,4-dimethoxy-benzamide CAS Name: N-[2-[[[3-(aminomethyl)phenyl]methyl-[cyclohexyl(oxo)methyl]amino]methyl]phenyl]-3,4-dimethoxybenzamide IUPAC Name: N-[2-[[[3-(aminomethyl)phenyl]methyl-(cyclohexanecarbonyl)amino]methyl]phenyl]-3,4-dimethoxybenzamide Traditional Name: N-[2-[[[3-(aminomethyl)benzyl]-(cyclohexanecarbonyl)amino]methyl]phenyl]-3,4-dimethoxy-benzamide Formula: C31H37N3O4 MolecularWeight: 515.64318

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC2=CC=CC=C2CN(CC3=CC=CC(=C3)CN)C(=O)C4CCCCC4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC2=CC=CC=C2CN(CC3=CC=CC(=C3)CN)C(=O)C4CCCCC4)OC

InChI

InChI=1S/C31H37N3O4/c1-37-28-16-15-25(18-29(28)38-2)30(35)33-27-14-7-6-13-26(27)21-34(31(36)24-11-4-3-5-12-24)20-23-10-8-9-22(17-23)19-32/h6-10,13-18,24H,3-5,11-12,19-21,32H2,1-2H3,(H,33,35)