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

Systemtic Name: methyl 4-(3-bromanyl-4,5-dimethoxy-phenyl)-4,7-dimethoxy-2-(2-methoxyethyl)-1-oxidanylidene-3H-isoquinoline-3-carboxylate Openeye Name: methyl 4-(3-bromo-4,5-dimethoxy-phenyl)-4,7-dimethoxy-2-(2-methoxyethyl)-1-oxo-3H-isoquinoline-3-carboxylate CAS Name: 4-(3-bromo-4,5-dimethoxyphenyl)-4,7-dimethoxy-2-(2-methoxyethyl)-1-oxo-3H-isoquinoline-3-carboxylic acid methyl ester IUPAC Name: methyl 4-(3-bromo-4,5-dimethoxyphenyl)-4,7-dimethoxy-2-(2-methoxyethyl)-1-oxo-3H-isoquinoline-3-carboxylate Traditional Name: 4-(3-bromo-4,5-dimethoxy-phenyl)-1-keto-4,7-dimethoxy-2-(2-methoxyethyl)-3H-isoquinoline-3-carboxylic acid methyl ester Formula: C24H28BrNO8 MolecularWeight: 538.38502

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C(C(C2=C(C1=O)C=C(C=C2)OC)(C3=CC(=C(C(=C3)Br)OC)OC)OC)C(=O)OC

Isomeric SMILES

COCCN1C(C(C2=C(C1=O)C=C(C=C2)OC)(C3=CC(=C(C(=C3)Br)OC)OC)OC)C(=O)OC

InChI

InChI=1S/C24H28BrNO8/c1-29-10-9-26-21(23(28)33-5)24(34-6,14-11-18(25)20(32-4)19(12-14)31-3)17-8-7-15(30-2)13-16(17)22(26)27/h7-8,11-13,21H,9-10H2,1-6H3