2-(6,7-dimethyl-4-oxidanylidene-1H-cinnolin-3-yl)ethanoic acid

Systemtic Name: 2-(6,7-dimethyl-4-oxidanylidene-1H-cinnolin-3-yl)ethanoic acid Openeye Name: 2-(6,7-dimethyl-4-oxo-1H-cinnolin-3-yl)acetic acid CAS Name: 2-(6,7-dimethyl-4-oxo-1H-cinnolin-3-yl)acetic acid IUPAC Name: 2-(6,7-dimethyl-4-oxo-1H-cinnolin-3-yl)acetic acid Traditional Name: 2-(4-keto-6,7-dimethyl-1H-cinnolin-3-yl)acetic acid Formula: C12H12N2O3 MolecularWeight: 232.23528

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=O)C(=NN2)CC(=O)O)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=O)C(=NN2)CC(=O)O)C

InChI

InChI=1S/C12H12N2O3/c1-6-3-8-9(4-7(6)2)13-14-10(12(8)17)5-11(15)16/h3-4H,5H2,1-2H3,(H,13,17)(H,15,16)