N-(4-azanylcyclohexyl)-N-[(4-benzamidophenyl)methyl]-3-fluoranyl-benzamide

Systemtic Name: N-(4-azanylcyclohexyl)-N-[(4-benzamidophenyl)methyl]-3-fluoranyl-benzamide Openeye Name: N-(4-aminocyclohexyl)-N-[(4-benzamidophenyl)methyl]-3-fluoro-benzamide CAS Name: N-(4-aminocyclohexyl)-N-[(4-benzamidophenyl)methyl]-3-fluorobenzamide IUPAC Name: N-(4-aminocyclohexyl)-N-[(4-benzamidophenyl)methyl]-3-fluorobenzamide Traditional Name: N-(4-aminocyclohexyl)-N-(4-benzamidobenzyl)-3-fluoro-benzamide Formula: C27H28FN3O2 MolecularWeight: 445.528523

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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