N-[3-[[(2-azanylcyclohexyl)-cyclohexylcarbonyl-amino]methyl]-4-chloranyl-phenyl]-2-methoxy-benzamide

Systemtic Name: N-[3-[[(2-azanylcyclohexyl)-cyclohexylcarbonyl-amino]methyl]-4-chloranyl-phenyl]-2-methoxy-benzamide Openeye Name: N-[3-[[(2-aminocyclohexyl)-(cyclohexanecarbonyl)amino]methyl]-4-chloro-phenyl]-2-methoxy-benzamide CAS Name: N-[3-[[(2-aminocyclohexyl)-[cyclohexyl(oxo)methyl]amino]methyl]-4-chlorophenyl]-2-methoxybenzamide IUPAC Name: N-[3-[[(2-aminocyclohexyl)-(cyclohexanecarbonyl)amino]methyl]-4-chlorophenyl]-2-methoxybenzamide Traditional Name: N-[3-[[(2-aminocyclohexyl)-(cyclohexanecarbonyl)amino]methyl]-4-chloro-phenyl]-2-methoxy-benzamide Formula: C28H36ClN3O3 MolecularWeight: 498.05674

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(=O)NC2=CC(=C(C=C2)Cl)CN(C3CCCCC3N)C(=O)C4CCCCC4

Isomeric SMILES

COC1=CC=CC=C1C(=O)NC2=CC(=C(C=C2)Cl)CN(C3CCCCC3N)C(=O)C4CCCCC4

InChI

InChI=1S/C28H36ClN3O3/c1-35-26-14-8-5-11-22(26)27(33)31-21-15-16-23(29)20(17-21)18-32(25-13-7-6-12-24(25)30)28(34)19-9-3-2-4-10-19/h5,8,11,14-17,19,24-25H,2-4,6-7,9-10,12-13,18,30H2,1H3,(H,31,33)