N-(4-bromanyl-2-methyl-phenyl)-6,7-dimethoxy-2-methyl-1-oxidanylidene-isoquinoline-4-carboxamide

Systemtic Name: N-(4-bromanyl-2-methyl-phenyl)-6,7-dimethoxy-2-methyl-1-oxidanylidene-isoquinoline-4-carboxamide Openeye Name: N-(4-bromo-2-methyl-phenyl)-6,7-dimethoxy-2-methyl-1-oxo-isoquinoline-4-carboxamide CAS Name: N-(4-bromo-2-methylphenyl)-6,7-dimethoxy-2-methyl-1-oxo-4-isoquinolinecarboxamide IUPAC Name: N-(4-bromo-2-methylphenyl)-6,7-dimethoxy-2-methyl-1-oxoisoquinoline-4-carboxamide Traditional Name: N-(4-bromo-2-methyl-phenyl)-1-keto-6,7-dimethoxy-2-methyl-isoquinoline-4-carboxamide Formula: C20H19BrN2O4 MolecularWeight: 431.27986

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H19BrN2O4/c1-11-7-12(21)5-6-16(11)22-19(24)15-10-23(2)20(25)14-9-18(27-4)17(26-3)8-13(14)15/h5-10H,1-4H3,(H,22,24)