(2R)-2-(2-methylquinolin-4-yl)sulfanylbutanedioate

Systemtic Name: (2R)-2-(2-methylquinolin-4-yl)sulfanylbutanedioate Openeye Name: (2R)-2-[(2-methyl-4-quinolyl)sulfanyl]butanedioate CAS Name: (2R)-2-[(2-methyl-4-quinolinyl)thio]butanedioate IUPAC Name: (2R)-2-(2-methylquinolin-4-yl)sulfanylbutanedioate Traditional Name: (2R)-2-[(2-methyl-4-quinolyl)thio]succinate Formula: C14H11NO4S-2 MolecularWeight: 289.30644

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=C1)SC(CC(=O)[O-])C(=O)[O-]

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=C1)S[C@H](CC(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C14H13NO4S/c1-8-6-11(9-4-2-3-5-10(9)15-8)20-12(14(18)19)7-13(16)17/h2-6,12H,7H2,1H3,(H,16,17)(H,18,19)/p-2/t12-/m1/s1