2-(6-methoxy-2-methyl-quinolin-4-yl)sulfanylbutanedioic acid hydrochloride

Systemtic Name: 2-(6-methoxy-2-methyl-quinolin-4-yl)sulfanylbutanedioic acid hydrochloride Openeye Name: 2-[(6-methoxy-2-methyl-4-quinolyl)sulfanyl]butanedioic acid hydrochloride CAS Name: 2-[(6-methoxy-2-methyl-4-quinolinyl)thio]butanedioic acid hydrochloride IUPAC Name: 2-(6-methoxy-2-methylquinolin-4-yl)sulfanylbutanedioic acid hydrochloride Traditional Name: 2-[(6-methoxy-2-methyl-4-quinolyl)thio]succinic acid hydrochloride Formula: C15H16ClNO5S MolecularWeight: 357.80924

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C(C=C2)OC)C(=C1)SC(CC(=O)O)C(=O)O.Cl

Isomeric SMILES

CC1=NC2=C(C=C(C=C2)OC)C(=C1)SC(CC(=O)O)C(=O)O.Cl

InChI

InChI=1S/C15H15NO5S.ClH/c1-8-5-12(22-13(15(19)20)7-14(17)18)10-6-9(21-2)3-4-11(10)16-8;/h3-6,13H,7H2,1-2H3,(H,17,18)(H,19,20);1H