N-[2-[[(2-azanylcyclohexyl)-(4-methoxyphenyl)carbonyl-amino]methyl]phenyl]-3-fluoranyl-benzamide

Systemtic Name: N-[2-[[(2-azanylcyclohexyl)-(4-methoxyphenyl)carbonyl-amino]methyl]phenyl]-3-fluoranyl-benzamide Openeye Name: N-[2-[[(2-aminocyclohexyl)-(4-methoxybenzoyl)amino]methyl]phenyl]-3-fluoro-benzamide CAS Name: N-[2-[[(2-aminocyclohexyl)-[(4-methoxyphenyl)-oxomethyl]amino]methyl]phenyl]-3-fluorobenzamide IUPAC Name: N-[2-[[(2-aminocyclohexyl)-(4-methoxybenzoyl)amino]methyl]phenyl]-3-fluorobenzamide Traditional Name: N-[2-[[(2-aminocyclohexyl)-p-anisoyl-amino]methyl]phenyl]-3-fluoro-benzamide Formula: C28H30FN3O3 MolecularWeight: 475.554503

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)N(CC2=CC=CC=C2NC(=O)C3=CC(=CC=C3)F)C4CCCCC4N

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)N(CC2=CC=CC=C2NC(=O)C3=CC(=CC=C3)F)C4CCCCC4N

InChI

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