2-(1-sulfanylbutan-2-yl)pentanedioic acid

Systemtic Name: 2-(1-sulfanylbutan-2-yl)pentanedioic acid Openeye Name: 2-[1-(sulfanylmethyl)propyl]pentanedioic acid CAS Name: 2-(1-mercaptobutan-2-yl)pentanedioic acid IUPAC Name: 2-(1-sulfanylbutan-2-yl)pentanedioic acid Traditional Name: 2-[1-(mercaptomethyl)propyl]glutaric acid Formula: C9H16O4S MolecularWeight: 220.28594

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CS)C(CCC(=O)O)C(=O)O

Isomeric SMILES

CCC(CS)C(CCC(=O)O)C(=O)O

InChI

InChI=1S/C9H16O4S/c1-2-6(5-14)7(9(12)13)3-4-8(10)11/h6-7,14H,2-5H2,1H3,(H,10,11)(H,12,13)