N-[2-[(6,7-dimethoxyisoquinolin-1-yl)methyl]-4,5-dimethoxy-phenyl]-2-(4-nitrophenyl)ethanamide

Systemtic Name: N-[2-[(6,7-dimethoxyisoquinolin-1-yl)methyl]-4,5-dimethoxy-phenyl]-2-(4-nitrophenyl)ethanamide Openeye Name: N-[2-[(6,7-dimethoxy-1-isoquinolyl)methyl]-4,5-dimethoxy-phenyl]-2-(4-nitrophenyl)acetamide CAS Name: N-[2-[(6,7-dimethoxy-1-isoquinolinyl)methyl]-4,5-dimethoxyphenyl]-2-(4-nitrophenyl)acetamide IUPAC Name: N-[2-[(6,7-dimethoxyisoquinolin-1-yl)methyl]-4,5-dimethoxyphenyl]-2-(4-nitrophenyl)acetamide Traditional Name: N-[2-[(6,7-dimethoxy-1-isoquinolyl)methyl]-4,5-dimethoxy-phenyl]-2-(4-nitrophenyl)acetamide Formula: C28H27N3O7 MolecularWeight: 517.52988

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C=CN=C2CC3=CC(=C(C=C3NC(=O)CC4=CC=C(C=C4)[N+](=O)[O-])OC)OC)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C=CN=C2CC3=CC(=C(C=C3NC(=O)CC4=CC=C(C=C4)[N+](=O)[O-])OC)OC)OC

InChI

InChI=1S/C28H27N3O7/c1-35-24-13-18-9-10-29-23(21(18)15-26(24)37-3)12-19-14-25(36-2)27(38-4)16-22(19)30-28(32)11-17-5-7-20(8-6-17)31(33)34/h5-10,13-16H,11-12H2,1-4H3,(H,30,32)