N-(4-azanylcyclohexyl)-N-[[2-chloranyl-5-(cyclohexylcarbonylamino)phenyl]methyl]-3,4-dimethoxy-benzamide

Systemtic Name: N-(4-azanylcyclohexyl)-N-[[2-chloranyl-5-(cyclohexylcarbonylamino)phenyl]methyl]-3,4-dimethoxy-benzamide Openeye Name: N-(4-aminocyclohexyl)-N-[[2-chloro-5-(cyclohexanecarbonylamino)phenyl]methyl]-3,4-dimethoxy-benzamide CAS Name: N-(4-aminocyclohexyl)-N-[[2-chloro-5-[[cyclohexyl(oxo)methyl]amino]phenyl]methyl]-3,4-dimethoxybenzamide IUPAC Name: N-(4-aminocyclohexyl)-N-[[2-chloro-5-(cyclohexanecarbonylamino)phenyl]methyl]-3,4-dimethoxybenzamide Traditional Name: N-(4-aminocyclohexyl)-N-[2-chloro-5-(cyclohexanecarbonylamino)benzyl]-3,4-dimethoxy-benzamide Formula: C29H38ClN3O4 MolecularWeight: 528.08272

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)N(CC2=C(C=CC(=C2)NC(=O)C3CCCCC3)Cl)C4CCC(CC4)N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)N(CC2=C(C=CC(=C2)NC(=O)C3CCCCC3)Cl)C4CCC(CC4)N)OC

InChI

InChI=1S/C29H38ClN3O4/c1-36-26-15-8-20(17-27(26)37-2)29(35)33(24-12-9-22(31)10-13-24)18-21-16-23(11-14-25(21)30)32-28(34)19-6-4-3-5-7-19/h8,11,14-17,19,22,24H,3-7,9-10,12-13,18,31H2,1-2H3,(H,32,34)