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2-[(2R)-2-carboxy-5-sulfanyl-pentyl]benzoic acid

2-[(2R)-2-carboxy-5-sulfanyl-pentyl]benzoic acid

Systemtic Name:2-[(2R)-2-carboxy-5-sulfanyl-pentyl]benzoic acid
Openeye Name:2-[(2R)-2-carboxy-5-sulfanyl-pentyl]benzoic acid
CAS Name:2-[(2R)-2-carboxy-5-mercaptopentyl]benzoic acid
IUPAC Name:2-[(2R)-2-carboxy-5-sulfanylpentyl]benzoic acid
Traditional Name:2-[(2R)-2-carboxy-5-mercapto-pentyl]benzoic acid
Formula: C13H16O4S
MolecularWeight: 268.32874
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CC(CCCS)C(=O)O)C(=O)O


Isomeric SMILES

C1=CC=C(C(=C1)C[C@@H](CCCS)C(=O)O)C(=O)O


InChI

InChI=1S/C13H16O4S/c14-12(15)10(5-3-7-18)8-9-4-1-2-6-11(9)13(16)17/h1-2,4,6,10,18H,3,5,7-8H2,(H,14,15)(H,16,17)/t10-/m1/s1


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