ethyl 2-methyl-1-oxidanylidene-isoquinoline-4-carboxylate

Systemtic Name: ethyl 2-methyl-1-oxidanylidene-isoquinoline-4-carboxylate Openeye Name: ethyl 2-methyl-1-oxo-isoquinoline-4-carboxylate CAS Name: 2-methyl-1-oxo-4-isoquinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-methyl-1-oxoisoquinoline-4-carboxylate Traditional Name: 1-keto-2-methyl-isoquinoline-4-carboxylic acid ethyl ester Formula: C13H13NO3 MolecularWeight: 231.24722

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN(C(=O)C2=CC=CC=C21)C

Isomeric SMILES

CCOC(=O)C1=CN(C(=O)C2=CC=CC=C21)C

InChI

InChI=1S/C13H13NO3/c1-3-17-13(16)11-8-14(2)12(15)10-7-5-4-6-9(10)11/h4-8H,3H2,1-2H3