4-methyl-1-oxidanylidene-2H-isoquinoline-3-carboxylic acid

Systemtic Name: 4-methyl-1-oxidanylidene-2H-isoquinoline-3-carboxylic acid Openeye Name: 4-methyl-1-oxo-2H-isoquinoline-3-carboxylic acid CAS Name: 4-methyl-1-oxo-2H-isoquinoline-3-carboxylic acid IUPAC Name: 4-methyl-1-oxo-2H-isoquinoline-3-carboxylic acid Traditional Name: 1-keto-4-methyl-2H-isoquinoline-3-carboxylic acid Formula: C11H9NO3 MolecularWeight: 203.19406

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=O)C2=CC=CC=C12)C(=O)O

Isomeric SMILES

CC1=C(NC(=O)C2=CC=CC=C12)C(=O)O

InChI

InChI=1S/C11H9NO3/c1-6-7-4-2-3-5-8(7)10(13)12-9(6)11(14)15/h2-5H,1H3,(H,12,13)(H,14,15)