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

Systemtic Name: methyl 4-[3,5-bis(bromanyl)-4-methoxy-phenyl]-6,7-dimethoxy-1-oxidanylidene-2-phenyl-isoquinoline-3-carboxylate Openeye Name: methyl 4-(3,5-dibromo-4-methoxy-phenyl)-6,7-dimethoxy-1-oxo-2-phenyl-isoquinoline-3-carboxylate CAS Name: 4-(3,5-dibromo-4-methoxyphenyl)-6,7-dimethoxy-1-oxo-2-phenyl-3-isoquinolinecarboxylic acid methyl ester IUPAC Name: methyl 4-(3,5-dibromo-4-methoxyphenyl)-6,7-dimethoxy-1-oxo-2-phenylisoquinoline-3-carboxylate Traditional Name: 4-(3,5-dibromo-4-methoxy-phenyl)-1-keto-6,7-dimethoxy-2-phenyl-isoquinoline-3-carboxylic acid methyl ester Formula: C26H21Br2NO6 MolecularWeight: 603.25604

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=C(N(C2=O)C3=CC=CC=C3)C(=O)OC)C4=CC(=C(C(=C4)Br)OC)Br)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=C(N(C2=O)C3=CC=CC=C3)C(=O)OC)C4=CC(=C(C(=C4)Br)OC)Br)OC

InChI

InChI=1S/C26H21Br2NO6/c1-32-20-12-16-17(13-21(20)33-2)25(30)29(15-8-6-5-7-9-15)23(26(31)35-4)22(16)14-10-18(27)24(34-3)19(28)11-14/h5-13H,1-4H3