2-phenyl-3-sulfanyl-butanedioic acid

Systemtic Name: 2-phenyl-3-sulfanyl-butanedioic acid Openeye Name: 2-phenyl-3-sulfanyl-butanedioic acid CAS Name: 2-mercapto-3-phenylbutanedioic acid IUPAC Name: 2-phenyl-3-sulfanylbutanedioic acid Traditional Name: 2-mercapto-3-phenyl-succinic acid Formula: C10H10O4S MolecularWeight: 226.249

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(C(=O)O)S)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C(C(C(=O)O)S)C(=O)O

InChI

InChI=1S/C10H10O4S/c11-9(12)7(8(15)10(13)14)6-4-2-1-3-5-6/h1-5,7-8,15H,(H,11,12)(H,13,14)