methyl 2-[2-(2-bromophenyl)ethanoylamino]-1-oxidanylidene-isoquinoline-4-carboxylate

Systemtic Name: methyl 2-[2-(2-bromophenyl)ethanoylamino]-1-oxidanylidene-isoquinoline-4-carboxylate Openeye Name: methyl 2-[[2-(2-bromophenyl)acetyl]amino]-1-oxo-isoquinoline-4-carboxylate CAS Name: 2-[[2-(2-bromophenyl)-1-oxoethyl]amino]-1-oxo-4-isoquinolinecarboxylic acid methyl ester IUPAC Name: methyl 2-[[2-(2-bromophenyl)acetyl]amino]-1-oxoisoquinoline-4-carboxylate Traditional Name: 2-[[2-(2-bromophenyl)acetyl]amino]-1-keto-isoquinoline-4-carboxylic acid methyl ester Formula: C19H15BrN2O4 MolecularWeight: 415.2374

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN(C(=O)C2=CC=CC=C21)NC(=O)CC3=CC=CC=C3Br

Isomeric SMILES

COC(=O)C1=CN(C(=O)C2=CC=CC=C21)NC(=O)CC3=CC=CC=C3Br

InChI

InChI=1S/C19H15BrN2O4/c1-26-19(25)15-11-22(18(24)14-8-4-3-7-13(14)15)21-17(23)10-12-6-2-5-9-16(12)20/h2-9,11H,10H2,1H3,(H,21,23)