(E)-3-[3,4-bis(oxidanyl)phenyl]prop-2-enoate sulfate

Systemtic Name: (E)-3-[3,4-bis(oxidanyl)phenyl]prop-2-enoate sulfate Openeye Name: (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate sulfate CAS Name: (E)-3-(3,4-dihydroxyphenyl)-2-propenoate sulfate IUPAC Name: (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate sulfate Traditional Name: (E)-3-(3,4-dihydroxyphenyl)acrylate sulfate Formula: C9H7O8S-3 MolecularWeight: 275.21208

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C=CC(=O)[O-])O)O.[O-]S(=O)(=O)[O-]

Isomeric SMILES

C1=CC(=C(C=C1/C=C/C(=O)[O-])O)O.[O-]S(=O)(=O)[O-]

InChI

InChI=1S/C9H8O4.H2O4S/c10-7-3-1-6(5-8(7)11)2-4-9(12)13;1-5(2,3)4/h1-5,10-11H,(H,12,13);(H2,1,2,3,4)/p-3/b4-2+;