2-(3-methyl-2-oxidanyl-1-oxidanylidene-isoquinolin-4-yl)ethanoic acid

Systemtic Name: 2-(3-methyl-2-oxidanyl-1-oxidanylidene-isoquinolin-4-yl)ethanoic acid Openeye Name: 2-(2-hydroxy-3-methyl-1-oxo-4-isoquinolyl)acetic acid CAS Name: 2-(2-hydroxy-3-methyl-1-oxo-4-isoquinolinyl)acetic acid IUPAC Name: 2-(2-hydroxy-3-methyl-1-oxoisoquinolin-4-yl)acetic acid Traditional Name: 2-(2-hydroxy-1-keto-3-methyl-4-isoquinolyl)acetic acid Formula: C12H11NO4 MolecularWeight: 233.22004

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2C(=O)N1O)CC(=O)O

Isomeric SMILES

CC1=C(C2=CC=CC=C2C(=O)N1O)CC(=O)O

InChI

InChI=1S/C12H11NO4/c1-7-10(6-11(14)15)8-4-2-3-5-9(8)12(16)13(7)17/h2-5,17H,6H2,1H3,(H,14,15)