methyl 4-(3-bromanyl-4,5-dimethoxy-phenyl)-2-(1H-indazol-6-yl)-6,7-dimethoxy-1-oxidanylidene-isoquinoline-3-carboxylate

Systemtic Name: methyl 4-(3-bromanyl-4,5-dimethoxy-phenyl)-2-(1H-indazol-6-yl)-6,7-dimethoxy-1-oxidanylidene-isoquinoline-3-carboxylate Openeye Name: methyl 4-(3-bromo-4,5-dimethoxy-phenyl)-2-(1H-indazol-6-yl)-6,7-dimethoxy-1-oxo-isoquinoline-3-carboxylate CAS Name: 4-(3-bromo-4,5-dimethoxyphenyl)-2-(1H-indazol-6-yl)-6,7-dimethoxy-1-oxo-3-isoquinolinecarboxylic acid methyl ester IUPAC Name: methyl 4-(3-bromo-4,5-dimethoxyphenyl)-2-(1H-indazol-6-yl)-6,7-dimethoxy-1-oxoisoquinoline-3-carboxylate Traditional Name: 4-(3-bromo-4,5-dimethoxy-phenyl)-2-(1H-indazol-6-yl)-1-keto-6,7-dimethoxy-isoquinoline-3-carboxylic acid methyl ester Formula: C28H24BrN3O7 MolecularWeight: 594.41006

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C2=C(N(C(=O)C3=CC(=C(C=C32)OC)OC)C4=CC5=C(C=C4)C=NN5)C(=O)OC)Br)OC

Isomeric SMILES

COC1=C(C(=CC(=C1)C2=C(N(C(=O)C3=CC(=C(C=C32)OC)OC)C4=CC5=C(C=C4)C=NN5)C(=O)OC)Br)OC

InChI

InChI=1S/C28H24BrN3O7/c1-35-21-11-17-18(12-22(21)36-2)27(33)32(16-7-6-14-13-30-31-20(14)10-16)25(28(34)39-5)24(17)15-8-19(29)26(38-4)23(9-15)37-3/h6-13H,1-5H3,(H,30,31)