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

Systemtic Name: N-[2-[[(4-azanylcyclohexyl)-(3-fluorophenyl)carbonyl-amino]methyl]phenyl]-3-methoxy-benzamide Openeye Name: N-[2-[[(4-aminocyclohexyl)-(3-fluorobenzoyl)amino]methyl]phenyl]-3-methoxy-benzamide CAS Name: N-[2-[[(4-aminocyclohexyl)-[(3-fluorophenyl)-oxomethyl]amino]methyl]phenyl]-3-methoxybenzamide IUPAC Name: N-[2-[[(4-aminocyclohexyl)-(3-fluorobenzoyl)amino]methyl]phenyl]-3-methoxybenzamide Traditional Name: N-[2-[[(4-aminocyclohexyl)-(3-fluorobenzoyl)amino]methyl]phenyl]-3-methoxy-benzamide Formula: C28H30FN3O3 MolecularWeight: 475.554503

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H30FN3O3/c1-35-25-10-5-7-19(17-25)27(33)31-26-11-3-2-6-21(26)18-32(24-14-12-23(30)13-15-24)28(34)20-8-4-9-22(29)16-20/h2-11,16-17,23-24H,12-15,18,30H2,1H3,(H,31,33)