[(E)-3-(1,3-benzodioxol-5-yl)prop-1-enyl] hydrogen sulfate

Systemtic Name: [(E)-3-(1,3-benzodioxol-5-yl)prop-1-enyl] hydrogen sulfate Openeye Name: [(E)-3-(1,3-benzodioxol-5-yl)prop-1-enyl] hydrogen sulfate CAS Name: sulfuric acid [(E)-3-(1,3-benzodioxol-5-yl)prop-1-enyl] ester IUPAC Name: [(E)-3-(1,3-benzodioxol-5-yl)prop-1-enyl] hydrogen sulfate Traditional Name: sulfuric acid [(E)-3-(1,3-benzodioxol-5-yl)prop-1-enyl] ester Formula: C10H10O6S MolecularWeight: 258.2478

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CC=COS(=O)(=O)O

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C/C=C/OS(=O)(=O)O

InChI

InChI=1S/C10H10O6S/c11-17(12,13)16-5-1-2-8-3-4-9-10(6-8)15-7-14-9/h1,3-6H,2,7H2,(H,11,12,13)/b5-1+