N-[4-[[(4-azanylcyclohexyl)-(phenylcarbonyl)amino]methyl]phenyl]-4-fluoranyl-benzamide

Systemtic Name: N-[4-[[(4-azanylcyclohexyl)-(phenylcarbonyl)amino]methyl]phenyl]-4-fluoranyl-benzamide Openeye Name: N-[4-[[(4-aminocyclohexyl)-benzoyl-amino]methyl]phenyl]-4-fluoro-benzamide CAS Name: N-[4-[[(4-aminocyclohexyl)-benzoylamino]methyl]phenyl]-4-fluorobenzamide IUPAC Name: N-[4-[[(4-aminocyclohexyl)-benzoylamino]methyl]phenyl]-4-fluorobenzamide Traditional Name: N-[4-[[(4-aminocyclohexyl)-benzoyl-amino]methyl]phenyl]-4-fluoro-benzamide Formula: C27H28FN3O2 MolecularWeight: 445.528523

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1N)N(CC2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)F)C(=O)C4=CC=CC=C4

Isomeric SMILES

C1CC(CCC1N)N(CC2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)F)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C27H28FN3O2/c28-22-10-8-20(9-11-22)26(32)30-24-14-6-19(7-15-24)18-31(25-16-12-23(29)13-17-25)27(33)21-4-2-1-3-5-21/h1-11,14-15,23,25H,12-13,16-18,29H2,(H,30,32)