2-(4-carboxyphenyl)sulfanylpropanedioic acid

Systemtic Name: 2-(4-carboxyphenyl)sulfanylpropanedioic acid Openeye Name: 2-(4-carboxyphenyl)sulfanylpropanedioic acid CAS Name: 2-[(4-carboxyphenyl)thio]propanedioic acid IUPAC Name: 2-(4-carboxyphenyl)sulfanylpropanedioic acid Traditional Name: 2-[(4-carboxyphenyl)thio]malonic acid Formula: C10H8O6S MolecularWeight: 256.23192

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)O)SC(C(=O)O)C(=O)O

Isomeric SMILES

C1=CC(=CC=C1C(=O)O)SC(C(=O)O)C(=O)O

InChI

InChI=1S/C10H8O6S/c11-8(12)5-1-3-6(4-2-5)17-7(9(13)14)10(15)16/h1-4,7H,(H,11,12)(H,13,14)(H,15,16)