7-chloranyl-3,6-dimethyl-4-oxidanylidene-1H-quinoline-2-carboxylic acid

Systemtic Name: 7-chloranyl-3,6-dimethyl-4-oxidanylidene-1H-quinoline-2-carboxylic acid Openeye Name: 7-chloro-3,6-dimethyl-4-oxo-1H-quinoline-2-carboxylic acid CAS Name: 7-chloro-3,6-dimethyl-4-oxo-1H-quinoline-2-carboxylic acid IUPAC Name: 7-chloro-3,6-dimethyl-4-oxo-1H-quinoline-2-carboxylic acid Traditional Name: 7-chloro-4-keto-3,6-dimethyl-1H-quinoline-2-carboxylic acid Formula: C12H10ClNO3 MolecularWeight: 251.6657

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=O)C(=C(N2)C(=O)O)C)Cl

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=O)C(=C(N2)C(=O)O)C)Cl

InChI

InChI=1S/C12H10ClNO3/c1-5-3-7-9(4-8(5)13)14-10(12(16)17)6(2)11(7)15/h3-4H,1-2H3,(H,14,15)(H,16,17)