6-chloranyl-1-ethyl-7-(4-methyl-1,3-thiazol-2-yl)-4-oxidanylidene-1H-quinolin-1-ium-3-carboxylic acid

Systemtic Name: 6-chloranyl-1-ethyl-7-(4-methyl-1,3-thiazol-2-yl)-4-oxidanylidene-1H-quinolin-1-ium-3-carboxylic acid Openeye Name: 6-chloro-1-ethyl-7-(4-methylthiazol-2-yl)-4-oxo-1H-quinolin-1-ium-3-carboxylic acid CAS Name: 6-chloro-1-ethyl-7-(4-methyl-2-thiazolyl)-4-oxo-1H-quinolin-1-ium-3-carboxylic acid IUPAC Name: 6-chloro-1-ethyl-7-(4-methyl-1,3-thiazol-2-yl)-4-oxo-1H-quinolin-1-ium-3-carboxylic acid Traditional Name: 6-chloro-1-ethyl-4-keto-7-(4-methylthiazol-2-yl)-1H-quinolin-1-ium-3-carboxylic acid Formula: C16H14ClN2O3S+ MolecularWeight: 349.81196

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1C=C(C(=O)C2=C1C=C(C(=C2)Cl)C3=NC(=CS3)C)C(=O)O

Isomeric SMILES

CC[NH+]1C=C(C(=O)C2=C1C=C(C(=C2)Cl)C3=NC(=CS3)C)C(=O)O

InChI

InChI=1S/C16H13ClN2O3S/c1-3-19-6-11(16(21)22)14(20)10-4-12(17)9(5-13(10)19)15-18-8(2)7-23-15/h4-7H,3H2,1-2H3,(H,21,22)/p+1