N-[2-[(6,7-dimethoxyisoquinolin-1-yl)methyl]-4,5-dimethoxy-phenyl]-4-methoxy-3-nitro-benzamide

Systemtic Name: N-[2-[(6,7-dimethoxyisoquinolin-1-yl)methyl]-4,5-dimethoxy-phenyl]-4-methoxy-3-nitro-benzamide Openeye Name: N-[2-[(6,7-dimethoxy-1-isoquinolyl)methyl]-4,5-dimethoxy-phenyl]-4-methoxy-3-nitro-benzamide CAS Name: N-[2-[(6,7-dimethoxy-1-isoquinolinyl)methyl]-4,5-dimethoxyphenyl]-4-methoxy-3-nitrobenzamide IUPAC Name: N-[2-[(6,7-dimethoxyisoquinolin-1-yl)methyl]-4,5-dimethoxyphenyl]-4-methoxy-3-nitrobenzamide Traditional Name: N-[2-[(6,7-dimethoxy-1-isoquinolyl)methyl]-4,5-dimethoxy-phenyl]-4-methoxy-3-nitro-benzamide Formula: C28H27N3O8 MolecularWeight: 533.52928

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC2=CC(=C(C=C2CC3=NC=CC4=CC(=C(C=C43)OC)OC)OC)OC)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC2=CC(=C(C=C2CC3=NC=CC4=CC(=C(C=C43)OC)OC)OC)OC)[N+](=O)[O-]

InChI

InChI=1S/C28H27N3O8/c1-35-23-7-6-17(11-22(23)31(33)34)28(32)30-20-15-27(39-5)25(37-3)13-18(20)10-21-19-14-26(38-4)24(36-2)12-16(19)8-9-29-21/h6-9,11-15H,10H2,1-5H3,(H,30,32)