6,7-dimethyl-2-oxidanylidene-1H-quinoline-4-carboxylic acid; ethanoic acid

Systemtic Name: 6,7-dimethyl-2-oxidanylidene-1H-quinoline-4-carboxylic acid; ethanoic acid Openeye Name: acetic acid; 6,7-dimethyl-2-oxo-1H-quinoline-4-carboxylic acid CAS Name: acetic acid; 6,7-dimethyl-2-oxo-1H-quinoline-4-carboxylic acid IUPAC Name: acetic acid; 6,7-dimethyl-2-oxo-1H-quinoline-4-carboxylic acid Traditional Name: acetic acid; 2-keto-6,7-dimethyl-1H-quinoline-4-carboxylic acid Formula: C14H15NO5 MolecularWeight: 277.2726

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=CC(=O)N2)C(=O)O)C.CC(=O)O

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=CC(=O)N2)C(=O)O)C.CC(=O)O

InChI

InChI=1S/C12H11NO3.C2H4O2/c1-6-3-8-9(12(15)16)5-11(14)13-10(8)4-7(6)2;1-2(3)4/h3-5H,1-2H3,(H,13,14)(H,15,16);1H3,(H,3,4)