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

Systemtic Name: N-(4-azanylcyclohexyl)-N-[[2-chloranyl-5-(cyclopentylcarbonylamino)phenyl]methyl]-3,4-dimethoxy-benzamide Openeye Name: N-(4-aminocyclohexyl)-N-[[2-chloro-5-(cyclopentanecarbonylamino)phenyl]methyl]-3,4-dimethoxy-benzamide CAS Name: N-(4-aminocyclohexyl)-N-[[2-chloro-5-[[cyclopentyl(oxo)methyl]amino]phenyl]methyl]-3,4-dimethoxybenzamide IUPAC Name: N-(4-aminocyclohexyl)-N-[[2-chloro-5-(cyclopentanecarbonylamino)phenyl]methyl]-3,4-dimethoxybenzamide Traditional Name: N-(4-aminocyclohexyl)-N-[2-chloro-5-(cyclopentanecarbonylamino)benzyl]-3,4-dimethoxy-benzamide Formula: C28H36ClN3O4 MolecularWeight: 514.05614

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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)C3CCCC3)Cl)C4CCC(CC4)N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)N(CC2=C(C=CC(=C2)NC(=O)C3CCCC3)Cl)C4CCC(CC4)N)OC

InChI

InChI=1S/C28H36ClN3O4/c1-35-25-14-7-19(16-26(25)36-2)28(34)32(23-11-8-21(30)9-12-23)17-20-15-22(10-13-24(20)29)31-27(33)18-5-3-4-6-18/h7,10,13-16,18,21,23H,3-6,8-9,11-12,17,30H2,1-2H3,(H,31,33)