N-[2-[[(2-azanylcyclohexyl)-(phenylcarbonyl)amino]methyl]phenyl]-3-fluoranyl-benzamide

Systemtic Name: N-[2-[[(2-azanylcyclohexyl)-(phenylcarbonyl)amino]methyl]phenyl]-3-fluoranyl-benzamide Openeye Name: N-[2-[[(2-aminocyclohexyl)-benzoyl-amino]methyl]phenyl]-3-fluoro-benzamide CAS Name: N-[2-[[(2-aminocyclohexyl)-benzoylamino]methyl]phenyl]-3-fluorobenzamide IUPAC Name: N-[2-[[(2-aminocyclohexyl)-benzoylamino]methyl]phenyl]-3-fluorobenzamide Traditional Name: N-[2-[[(2-aminocyclohexyl)-benzoyl-amino]methyl]phenyl]-3-fluoro-benzamide Formula: C27H28FN3O2 MolecularWeight: 445.528523

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)N)N(CC2=CC=CC=C2NC(=O)C3=CC(=CC=C3)F)C(=O)C4=CC=CC=C4

Isomeric SMILES

C1CCC(C(C1)N)N(CC2=CC=CC=C2NC(=O)C3=CC(=CC=C3)F)C(=O)C4=CC=CC=C4

InChI

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