methyl 4-methyl-3-[(1-oxidanylidene-2H-isoquinolin-3-yl)carbonylamino]benzoate

Systemtic Name: methyl 4-methyl-3-[(1-oxidanylidene-2H-isoquinolin-3-yl)carbonylamino]benzoate Openeye Name: methyl 4-methyl-3-[(1-oxo-2H-isoquinoline-3-carbonyl)amino]benzoate CAS Name: 4-methyl-3-[[oxo-(1-oxo-2H-isoquinolin-3-yl)methyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-methyl-3-[(1-oxo-2H-isoquinoline-3-carbonyl)amino]benzoate Traditional Name: 3-[(1-keto-2H-isoquinoline-3-carbonyl)amino]-4-methyl-benzoic acid methyl ester Formula: C19H16N2O4 MolecularWeight: 336.34134

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)C2=CC3=CC=CC=C3C(=O)N2

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)C2=CC3=CC=CC=C3C(=O)N2

InChI

InChI=1S/C19H16N2O4/c1-11-7-8-13(19(24)25-2)10-15(11)20-18(23)16-9-12-5-3-4-6-14(12)17(22)21-16/h3-10H,1-2H3,(H,20,23)(H,21,22)