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

Systemtic Name: N-[2-[[[3-(aminomethyl)phenyl]methyl-cyclohexylcarbonyl-amino]methyl]phenyl]benzamide Openeye Name: N-[2-[[[3-(aminomethyl)phenyl]methyl-(cyclohexanecarbonyl)amino]methyl]phenyl]benzamide CAS Name: N-[2-[[[3-(aminomethyl)phenyl]methyl-[cyclohexyl(oxo)methyl]amino]methyl]phenyl]benzamide IUPAC Name: N-[2-[[[3-(aminomethyl)phenyl]methyl-(cyclohexanecarbonyl)amino]methyl]phenyl]benzamide Traditional Name: N-[2-[[[3-(aminomethyl)benzyl]-(cyclohexanecarbonyl)amino]methyl]phenyl]benzamide Formula: C29H33N3O2 MolecularWeight: 455.59122

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)N(CC2=CC=CC(=C2)CN)CC3=CC=CC=C3NC(=O)C4=CC=CC=C4

Isomeric SMILES

C1CCC(CC1)C(=O)N(CC2=CC=CC(=C2)CN)CC3=CC=CC=C3NC(=O)C4=CC=CC=C4

InChI

InChI=1S/C29H33N3O2/c30-19-22-10-9-11-23(18-22)20-32(29(34)25-14-5-2-6-15-25)21-26-16-7-8-17-27(26)31-28(33)24-12-3-1-4-13-24/h1,3-4,7-13,16-18,25H,2,5-6,14-15,19-21,30H2,(H,31,33)