2-(6-chloranyl-1-methyl-2-oxidanylidene-quinolin-4-yl)sulfanylethanoic acid

Systemtic Name: 2-(6-chloranyl-1-methyl-2-oxidanylidene-quinolin-4-yl)sulfanylethanoic acid Openeye Name: 2-[(6-chloro-1-methyl-2-oxo-4-quinolyl)sulfanyl]acetic acid CAS Name: 2-[(6-chloro-1-methyl-2-oxo-4-quinolinyl)thio]acetic acid IUPAC Name: 2-(6-chloro-1-methyl-2-oxoquinolin-4-yl)sulfanylacetic acid Traditional Name: 2-[(6-chloro-2-keto-1-methyl-4-quinolyl)thio]acetic acid Formula: C12H10ClNO3S MolecularWeight: 283.7307

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)Cl)C(=CC1=O)SCC(=O)O

Isomeric SMILES

CN1C2=C(C=C(C=C2)Cl)C(=CC1=O)SCC(=O)O

InChI

InChI=1S/C12H10ClNO3S/c1-14-9-3-2-7(13)4-8(9)10(5-11(14)15)18-6-12(16)17/h2-5H,6H2,1H3,(H,16,17)