(2R)-2-(6-methoxy-2-methyl-quinolin-4-yl)sulfanylbutanedioate

Systemtic Name: (2R)-2-(6-methoxy-2-methyl-quinolin-4-yl)sulfanylbutanedioate Openeye Name: (2R)-2-[(6-methoxy-2-methyl-4-quinolyl)sulfanyl]butanedioate CAS Name: (2R)-2-[(6-methoxy-2-methyl-4-quinolinyl)thio]butanedioate IUPAC Name: (2R)-2-(6-methoxy-2-methylquinolin-4-yl)sulfanylbutanedioate Traditional Name: (2R)-2-[(6-methoxy-2-methyl-4-quinolyl)thio]succinate Formula: C15H13NO5S-2 MolecularWeight: 319.33242

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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-]

Isomeric SMILES

CC1=NC2=C(C=C(C=C2)OC)C(=C1)S[C@H](CC(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C15H15NO5S/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)/p-2/t13-/m1/s1