[4-[(2S,3R)-3-(1,3-benzodioxol-5-ylmethoxymethyl)-4-ethanoyl-5-oxidanylidene-oxolan-2-yl]-2-methoxy-phenyl] methanesulfonate

Systemtic Name: [4-[(2S,3R)-3-(1,3-benzodioxol-5-ylmethoxymethyl)-4-ethanoyl-5-oxidanylidene-oxolan-2-yl]-2-methoxy-phenyl] methanesulfonate Openeye Name: [4-[(2S,3R)-4-acetyl-3-(1,3-benzodioxol-5-ylmethoxymethyl)-5-oxo-tetrahydrofuran-2-yl]-2-methoxy-phenyl] methanesulfonate CAS Name: methanesulfonic acid [4-[(2S,3R)-4-acetyl-3-(1,3-benzodioxol-5-ylmethoxymethyl)-5-oxo-2-oxolanyl]-2-methoxyphenyl] ester IUPAC Name: [4-[(2S,3R)-4-acetyl-3-(1,3-benzodioxol-5-ylmethoxymethyl)-5-oxooxolan-2-yl]-2-methoxyphenyl] methanesulfonate Traditional Name: methanesulfonic acid [4-[(2S,3R)-4-acetyl-5-keto-3-(piperonyloxymethyl)tetrahydrofuran-2-yl]-2-methoxy-phenyl] ester Formula: C23H24O10S MolecularWeight: 492.49566

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1C(C(OC1=O)C2=CC(=C(C=C2)OS(=O)(=O)C)OC)COCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC(=O)C1[C@@H]([C@H](OC1=O)C2=CC(=C(C=C2)OS(=O)(=O)C)OC)COCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C23H24O10S/c1-13(24)21-16(11-29-10-14-4-6-17-20(8-14)31-12-30-17)22(32-23(21)25)15-5-7-18(19(9-15)28-2)33-34(3,26)27/h4-9,16,21-22H,10-12H2,1-3H3/t16-,21?,22+/m0/s1