(2R)-2-(6-fluoranyl-2-methyl-quinolin-4-yl)sulfanylbutanedioic acid

Systemtic Name: (2R)-2-(6-fluoranyl-2-methyl-quinolin-4-yl)sulfanylbutanedioic acid Openeye Name: (2R)-2-[(6-fluoro-2-methyl-4-quinolyl)sulfanyl]butanedioic acid CAS Name: (2R)-2-[(6-fluoro-2-methyl-4-quinolinyl)thio]butanedioic acid IUPAC Name: (2R)-2-(6-fluoro-2-methylquinolin-4-yl)sulfanylbutanedioic acid Traditional Name: (2R)-2-[(6-fluoro-2-methyl-4-quinolyl)thio]succinic acid Formula: C14H12FNO4S MolecularWeight: 309.312783

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C(C=C2)F)C(=C1)SC(CC(=O)O)C(=O)O

Isomeric SMILES

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

InChI

InChI=1S/C14H12FNO4S/c1-7-4-11(21-12(14(19)20)6-13(17)18)9-5-8(15)2-3-10(9)16-7/h2-5,12H,6H2,1H3,(H,17,18)(H,19,20)/t12-/m1/s1