6-chloranyl-7-(4,5-dimethyl-1,3-thiazol-2-yl)-1-ethyl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 6-chloranyl-7-(4,5-dimethyl-1,3-thiazol-2-yl)-1-ethyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 6-chloro-7-(4,5-dimethylthiazol-2-yl)-1-ethyl-4-oxo-quinoline-3-carboxylic acid CAS Name: 6-chloro-7-(4,5-dimethyl-2-thiazolyl)-1-ethyl-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 6-chloro-7-(4,5-dimethyl-1,3-thiazol-2-yl)-1-ethyl-4-oxoquinoline-3-carboxylic acid Traditional Name: 6-chloro-7-(4,5-dimethylthiazol-2-yl)-1-ethyl-4-keto-quinoline-3-carboxylic acid Formula: C17H15ClN2O3S MolecularWeight: 362.8306

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=CC(=C(C=C21)C3=NC(=C(S3)C)C)Cl)C(=O)O

Isomeric SMILES

CCN1C=C(C(=O)C2=CC(=C(C=C21)C3=NC(=C(S3)C)C)Cl)C(=O)O

InChI

InChI=1S/C17H15ClN2O3S/c1-4-20-7-12(17(22)23)15(21)11-5-13(18)10(6-14(11)20)16-19-8(2)9(3)24-16/h5-7H,4H2,1-3H3,(H,22,23)