3-phenyl-2-sulfo-pentanedioic acid

Systemtic Name: 3-phenyl-2-sulfo-pentanedioic acid Openeye Name: 3-phenyl-2-sulfo-pentanedioic acid CAS Name: 3-phenyl-2-sulfopentanedioic acid IUPAC Name: 3-phenyl-2-sulfopentanedioic acid Traditional Name: 3-phenyl-2-sulfo-glutaric acid Formula: C11H12O7S MolecularWeight: 288.27378

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H12O7S/c12-9(13)6-8(7-4-2-1-3-5-7)10(11(14)15)19(16,17)18/h1-5,8,10H,6H2,(H,12,13)(H,14,15)(H,16,17,18)