(2-methoxy-5-methyl-phenyl)methyl 1-oxidanylidene-2H-isoquinoline-3-carboxylate

Systemtic Name: (2-methoxy-5-methyl-phenyl)methyl 1-oxidanylidene-2H-isoquinoline-3-carboxylate Openeye Name: (2-methoxy-5-methyl-phenyl)methyl 1-oxo-2H-isoquinoline-3-carboxylate CAS Name: 1-oxo-2H-isoquinoline-3-carboxylic acid (2-methoxy-5-methylphenyl)methyl ester IUPAC Name: (2-methoxy-5-methylphenyl)methyl 1-oxo-2H-isoquinoline-3-carboxylate Traditional Name: 1-keto-2H-isoquinoline-3-carboxylic acid (2-methoxy-5-methyl-benzyl) ester Formula: C19H17NO4 MolecularWeight: 323.34258

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H17NO4/c1-12-7-8-17(23-2)14(9-12)11-24-19(22)16-10-13-5-3-4-6-15(13)18(21)20-16/h3-10H,11H2,1-2H3,(H,20,21)