N-(2-azanylcyclohexyl)-N-[(4-benzamidophenyl)methyl]-3-fluoranyl-benzamide

Systemtic Name: N-(2-azanylcyclohexyl)-N-[(4-benzamidophenyl)methyl]-3-fluoranyl-benzamide Openeye Name: N-(2-aminocyclohexyl)-N-[(4-benzamidophenyl)methyl]-3-fluoro-benzamide CAS Name: N-(2-aminocyclohexyl)-N-[(4-benzamidophenyl)methyl]-3-fluorobenzamide IUPAC Name: N-(2-aminocyclohexyl)-N-[(4-benzamidophenyl)methyl]-3-fluorobenzamide Traditional Name: N-(2-aminocyclohexyl)-N-(4-benzamidobenzyl)-3-fluoro-benzamide Formula: C27H28FN3O2 MolecularWeight: 445.528523

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)N)N(CC2=CC=C(C=C2)NC(=O)C3=CC=CC=C3)C(=O)C4=CC(=CC=C4)F

Isomeric SMILES

C1CCC(C(C1)N)N(CC2=CC=C(C=C2)NC(=O)C3=CC=CC=C3)C(=O)C4=CC(=CC=C4)F

InChI

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