[3-(1,3-benzodioxol-5-yl)-1-(hydroxymethyl)-4-(4-methylsulfonylphenyl)cyclopent-3-en-1-yl]methanol

Systemtic Name: [3-(1,3-benzodioxol-5-yl)-1-(hydroxymethyl)-4-(4-methylsulfonylphenyl)cyclopent-3-en-1-yl]methanol Openeye Name: [3-(1,3-benzodioxol-5-yl)-1-(hydroxymethyl)-4-(4-methylsulfonylphenyl)cyclopent-3-en-1-yl]methanol CAS Name: [3-(1,3-benzodioxol-5-yl)-1-(hydroxymethyl)-4-(4-methylsulfonylphenyl)-1-cyclopent-3-enyl]methanol IUPAC Name: [3-(1,3-benzodioxol-5-yl)-1-(hydroxymethyl)-4-(4-methylsulfonylphenyl)cyclopent-3-en-1-yl]methanol Traditional Name: [3-(1,3-benzodioxol-5-yl)-4-(4-mesylphenyl)-1-methylol-cyclopent-3-en-1-yl]methanol Formula: C21H22O6S MolecularWeight: 402.46078

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C2=C(CC(C2)(CO)CO)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C2=C(CC(C2)(CO)CO)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C21H22O6S/c1-28(24,25)16-5-2-14(3-6-16)17-9-21(11-22,12-23)10-18(17)15-4-7-19-20(8-15)27-13-26-19/h2-8,22-23H,9-13H2,1H3