prop-2-ene-1-sulfonate; (E)-4-sulfohex-2-enoate

Systemtic Name: prop-2-ene-1-sulfonate; (E)-4-sulfohex-2-enoate Openeye Name: prop-2-ene-1-sulfonate; (E)-4-sulfohex-2-enoate CAS Name: 2-propene-1-sulfonate; (E)-4-sulfo-2-hexenoate IUPAC Name: prop-2-ene-1-sulfonate; (E)-4-sulfohex-2-enoate Traditional Name: prop-2-ene-1-sulfonate; (E)-4-sulfohex-2-enoate Formula: C9H14O8S2-2 MolecularWeight: 314.33266

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C=CC(=O)[O-])S(=O)(=O)O.C=CCS(=O)(=O)[O-]

Isomeric SMILES

CCC(/C=C/C(=O)[O-])S(=O)(=O)O.C=CCS(=O)(=O)[O-]

InChI

InChI=1S/C6H10O5S.C3H6O3S/c1-2-5(12(9,10)11)3-4-6(7)8;1-2-3-7(4,5)6/h3-5H,2H2,1H3,(H,7,8)(H,9,10,11);2H,1,3H2,(H,4,5,6)/p-2/b4-3+;