4-oxidanylidene-4-phenyl-2-sulfo-butanoic acid

Systemtic Name: 4-oxidanylidene-4-phenyl-2-sulfo-butanoic acid Openeye Name: 4-oxo-4-phenyl-2-sulfo-butanoic acid CAS Name: 4-oxo-4-phenyl-2-sulfobutanoic acid IUPAC Name: 4-oxo-4-phenyl-2-sulfobutanoic acid Traditional Name: 4-keto-4-phenyl-2-sulfo-butyric acid Formula: C10H10O6S MolecularWeight: 258.2478

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H10O6S/c11-8(7-4-2-1-3-5-7)6-9(10(12)13)17(14,15)16/h1-5,9H,6H2,(H,12,13)(H,14,15,16)