N-(2-bromanyl-4-methyl-phenyl)-2-(4-methoxyphenyl)-1-oxidanylidene-isoquinoline-4-carboxamide

Systemtic Name: N-(2-bromanyl-4-methyl-phenyl)-2-(4-methoxyphenyl)-1-oxidanylidene-isoquinoline-4-carboxamide Openeye Name: N-(2-bromo-4-methyl-phenyl)-2-(4-methoxyphenyl)-1-oxo-isoquinoline-4-carboxamide CAS Name: N-(2-bromo-4-methylphenyl)-2-(4-methoxyphenyl)-1-oxo-4-isoquinolinecarboxamide IUPAC Name: N-(2-bromo-4-methylphenyl)-2-(4-methoxyphenyl)-1-oxoisoquinoline-4-carboxamide Traditional Name: N-(2-bromo-4-methyl-phenyl)-1-keto-2-(4-methoxyphenyl)isoquinoline-4-carboxamide Formula: C24H19BrN2O3 MolecularWeight: 463.32326

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C2=CN(C(=O)C3=CC=CC=C32)C4=CC=C(C=C4)OC)Br

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)C2=CN(C(=O)C3=CC=CC=C32)C4=CC=C(C=C4)OC)Br

InChI

InChI=1S/C24H19BrN2O3/c1-15-7-12-22(21(25)13-15)26-23(28)20-14-27(16-8-10-17(30-2)11-9-16)24(29)19-6-4-3-5-18(19)20/h3-14H,1-2H3,(H,26,28)