4-oxidanylidene-4-(2-oxidanylpropoxy)-3-sulfo-butanoate

Systemtic Name: 4-oxidanylidene-4-(2-oxidanylpropoxy)-3-sulfo-butanoate Openeye Name: 4-(2-hydroxypropoxy)-4-oxo-3-sulfo-butanoate CAS Name: 4-(2-hydroxypropoxy)-4-oxo-3-sulfobutanoate IUPAC Name: 4-(2-hydroxypropoxy)-4-oxo-3-sulfobutanoate Traditional Name: 4-(2-hydroxypropoxy)-4-keto-3-sulfo-butyrate Formula: C7H11O8S- MolecularWeight: 255.22244

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC(=O)C(CC(=O)[O-])S(=O)(=O)O)O

Isomeric SMILES

CC(COC(=O)C(CC(=O)[O-])S(=O)(=O)O)O

InChI

InChI=1S/C7H12O8S/c1-4(8)3-15-7(11)5(2-6(9)10)16(12,13)14/h4-5,8H,2-3H2,1H3,(H,9,10)(H,12,13,14)/p-1