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

Systemtic Name: N-[3-[[(2-azanylcyclohexyl)-(4-methoxyphenyl)carbonyl-amino]methyl]phenyl]-3-chloranyl-benzamide Openeye Name: N-[3-[[(2-aminocyclohexyl)-(4-methoxybenzoyl)amino]methyl]phenyl]-3-chloro-benzamide CAS Name: N-[3-[[(2-aminocyclohexyl)-[(4-methoxyphenyl)-oxomethyl]amino]methyl]phenyl]-3-chlorobenzamide IUPAC Name: N-[3-[[(2-aminocyclohexyl)-(4-methoxybenzoyl)amino]methyl]phenyl]-3-chlorobenzamide Traditional Name: N-[3-[[(2-aminocyclohexyl)-p-anisoyl-amino]methyl]phenyl]-3-chloro-benzamide Formula: C28H30ClN3O3 MolecularWeight: 492.0091

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)N(CC2=CC(=CC=C2)NC(=O)C3=CC(=CC=C3)Cl)C4CCCCC4N

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)N(CC2=CC(=CC=C2)NC(=O)C3=CC(=CC=C3)Cl)C4CCCCC4N

InChI

InChI=1S/C28H30ClN3O3/c1-35-24-14-12-20(13-15-24)28(34)32(26-11-3-2-10-25(26)30)18-19-6-4-9-23(16-19)31-27(33)21-7-5-8-22(29)17-21/h4-9,12-17,25-26H,2-3,10-11,18,30H2,1H3,(H,31,33)