O3-ethyl O2-methyl 4-(3-bromanyl-4,5-dimethoxy-phenyl)-6,7-dimethoxy-5-methyl-1-oxidanylidene-isoquinoline-2,3-dicarboxylate

Systemtic Name: O3-ethyl O2-methyl 4-(3-bromanyl-4,5-dimethoxy-phenyl)-6,7-dimethoxy-5-methyl-1-oxidanylidene-isoquinoline-2,3-dicarboxylate Openeye Name: O3-ethyl O2-methyl 4-(3-bromo-4,5-dimethoxy-phenyl)-6,7-dimethoxy-5-methyl-1-oxo-isoquinoline-2,3-dicarboxylate CAS Name: 4-(3-bromo-4,5-dimethoxyphenyl)-6,7-dimethoxy-5-methyl-1-oxoisoquinoline-2,3-dicarboxylic acid O3-ethyl ester O2-methyl ester IUPAC Name: 3-O-ethyl 2-O-methyl 4-(3-bromo-4,5-dimethoxyphenyl)-6,7-dimethoxy-5-methyl-1-oxoisoquinoline-2,3-dicarboxylate Traditional Name: 4-(3-bromo-4,5-dimethoxy-phenyl)-1-keto-6,7-dimethoxy-5-methyl-isoquinoline-2,3-dicarboxylic acid O3-ethyl ester O2-methyl ester Formula: C25H26BrNO9 MolecularWeight: 564.37924

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(C(=C(C=C2C(=O)N1C(=O)OC)OC)OC)C)C3=CC(=C(C(=C3)Br)OC)OC

Isomeric SMILES

CCOC(=O)C1=C(C2=C(C(=C(C=C2C(=O)N1C(=O)OC)OC)OC)C)C3=CC(=C(C(=C3)Br)OC)OC

InChI

InChI=1S/C25H26BrNO9/c1-8-36-24(29)20-19(13-9-15(26)22(34-6)16(10-13)31-3)18-12(2)21(33-5)17(32-4)11-14(18)23(28)27(20)25(30)35-7/h9-11H,8H2,1-7H3