2-(3-sulfanylbutan-2-yl)pentanedioic acid

Systemtic Name: 2-(3-sulfanylbutan-2-yl)pentanedioic acid Openeye Name: 2-(1-methyl-2-sulfanyl-propyl)pentanedioic acid CAS Name: 2-(3-mercaptobutan-2-yl)pentanedioic acid IUPAC Name: 2-(3-sulfanylbutan-2-yl)pentanedioic acid Traditional Name: 2-(2-mercapto-1-methyl-propyl)glutaric acid Formula: C9H16O4S MolecularWeight: 220.28594

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C)S)C(CCC(=O)O)C(=O)O

Isomeric SMILES

CC(C(C)S)C(CCC(=O)O)C(=O)O

InChI

InChI=1S/C9H16O4S/c1-5(6(2)14)7(9(12)13)3-4-8(10)11/h5-7,14H,3-4H2,1-2H3,(H,10,11)(H,12,13)