methyl 2-[3-(aminocarbamoyl)phenyl]-4-(3-bromanyl-4,5-dimethoxy-phenyl)-6,7-dimethoxy-1-oxidanylidene-isoquinoline-3-carboxylate

Systemtic Name: methyl 2-[3-(aminocarbamoyl)phenyl]-4-(3-bromanyl-4,5-dimethoxy-phenyl)-6,7-dimethoxy-1-oxidanylidene-isoquinoline-3-carboxylate Openeye Name: methyl 4-(3-bromo-4,5-dimethoxy-phenyl)-2-[3-(hydrazinecarbonyl)phenyl]-6,7-dimethoxy-1-oxo-isoquinoline-3-carboxylate CAS Name: 4-(3-bromo-4,5-dimethoxyphenyl)-2-[3-(hydrazinecarbonyl)phenyl]-6,7-dimethoxy-1-oxo-3-isoquinolinecarboxylic acid methyl ester IUPAC Name: methyl 4-(3-bromo-4,5-dimethoxyphenyl)-2-[3-(hydrazinecarbonyl)phenyl]-6,7-dimethoxy-1-oxoisoquinoline-3-carboxylate Traditional Name: 4-(3-bromo-4,5-dimethoxy-phenyl)-2-(3-carbazoylphenyl)-1-keto-6,7-dimethoxy-isoquinoline-3-carboxylic acid methyl ester Formula: C28H26BrN3O8 MolecularWeight: 612.42534

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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=CC=CC(=C4)C(=O)NN)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=CC=CC(=C4)C(=O)NN)C(=O)OC)Br)OC

InChI

InChI=1S/C28H26BrN3O8/c1-36-20-12-17-18(13-21(20)37-2)27(34)32(16-8-6-7-14(9-16)26(33)31-30)24(28(35)40-5)23(17)15-10-19(29)25(39-4)22(11-15)38-3/h6-13H,30H2,1-5H3,(H,31,33)