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

Systemtic Name: 6-chloranyl-1-ethyl-4-oxidanylidene-7-(1,3-thiazol-2-yl)-1H-quinolin-1-ium-3-carboxylic acid Openeye Name: 6-chloro-1-ethyl-4-oxo-7-thiazol-2-yl-1H-quinolin-1-ium-3-carboxylic acid CAS Name: 6-chloro-1-ethyl-4-oxo-7-(2-thiazolyl)-1H-quinolin-1-ium-3-carboxylic acid IUPAC Name: 6-chloro-1-ethyl-4-oxo-7-(1,3-thiazol-2-yl)-1H-quinolin-1-ium-3-carboxylic acid Traditional Name: 6-chloro-1-ethyl-4-keto-7-thiazol-2-yl-1H-quinolin-1-ium-3-carboxylic acid Formula: C15H12ClN2O3S+ MolecularWeight: 335.78538

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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(=O)O

Isomeric SMILES

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

InChI

InChI=1S/C15H11ClN2O3S/c1-2-18-7-10(15(20)21)13(19)9-5-11(16)8(6-12(9)18)14-17-3-4-22-14/h3-7H,2H2,1H3,(H,20,21)/p+1