[3-(1,3-benzodioxol-5-yl)-3-oxidanyl-butyl] methanesulfonate

Systemtic Name: [3-(1,3-benzodioxol-5-yl)-3-oxidanyl-butyl] methanesulfonate Openeye Name: [3-(1,3-benzodioxol-5-yl)-3-hydroxy-butyl] methanesulfonate CAS Name: methanesulfonic acid [3-(1,3-benzodioxol-5-yl)-3-hydroxybutyl] ester IUPAC Name: [3-(1,3-benzodioxol-5-yl)-3-hydroxybutyl] methanesulfonate Traditional Name: methanesulfonic acid [3-(1,3-benzodioxol-5-yl)-3-hydroxy-butyl] ester Formula: C12H16O6S MolecularWeight: 288.31684

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCOS(=O)(=O)C)(C1=CC2=C(C=C1)OCO2)O

Isomeric SMILES

CC(CCOS(=O)(=O)C)(C1=CC2=C(C=C1)OCO2)O

InChI

InChI=1S/C12H16O6S/c1-12(13,5-6-18-19(2,14)15)9-3-4-10-11(7-9)17-8-16-10/h3-4,7,13H,5-6,8H2,1-2H3