(E)-2-methyl-3-[6-(4-methylsulfonylphenyl)-1,3-benzodioxol-5-yl]prop-2-en-1-ol

Systemtic Name: (E)-2-methyl-3-[6-(4-methylsulfonylphenyl)-1,3-benzodioxol-5-yl]prop-2-en-1-ol Openeye Name: (E)-2-methyl-3-[6-(4-methylsulfonylphenyl)-1,3-benzodioxol-5-yl]prop-2-en-1-ol CAS Name: (E)-2-methyl-3-[6-(4-methylsulfonylphenyl)-1,3-benzodioxol-5-yl]-2-propen-1-ol IUPAC Name: (E)-2-methyl-3-[6-(4-methylsulfonylphenyl)-1,3-benzodioxol-5-yl]prop-2-en-1-ol Traditional Name: (E)-3-[6-(4-mesylphenyl)-1,3-benzodioxol-5-yl]-2-methyl-prop-2-en-1-ol Formula: C18H18O5S MolecularWeight: 346.39752

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC1=CC2=C(C=C1C3=CC=C(C=C3)S(=O)(=O)C)OCO2)CO

Isomeric SMILES

C/C(=C\C1=CC2=C(C=C1C3=CC=C(C=C3)S(=O)(=O)C)OCO2)/CO

InChI

InChI=1S/C18H18O5S/c1-12(10-19)7-14-8-17-18(23-11-22-17)9-16(14)13-3-5-15(6-4-13)24(2,20)21/h3-9,19H,10-11H2,1-2H3/b12-7+