4-oxidanylidene-4-phenoxy-2-sulfo-butanoic acid

Systemtic Name: 4-oxidanylidene-4-phenoxy-2-sulfo-butanoic acid Openeye Name: 4-oxo-4-phenoxy-2-sulfo-butanoic acid CAS Name: 4-oxo-4-phenoxy-2-sulfobutanoic acid IUPAC Name: 4-oxo-4-phenoxy-2-sulfobutanoic acid Traditional Name: 4-keto-4-phenoxy-2-sulfo-butyric acid Formula: C10H10O7S MolecularWeight: 274.2472

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H10O7S/c11-9(17-7-4-2-1-3-5-7)6-8(10(12)13)18(14,15)16/h1-5,8H,6H2,(H,12,13)(H,14,15,16)