2-(3-methoxyphenyl)-6-(4-methylsulfonylphenyl)-3a,4-dihydro-1,3-benzodioxole

Systemtic Name: 2-(3-methoxyphenyl)-6-(4-methylsulfonylphenyl)-3a,4-dihydro-1,3-benzodioxole Openeye Name: 2-(3-methoxyphenyl)-6-(4-methylsulfonylphenyl)-3a,4-dihydro-1,3-benzodioxole CAS Name: 2-(3-methoxyphenyl)-6-(4-methylsulfonylphenyl)-3a,4-dihydro-1,3-benzodioxole IUPAC Name: 2-(3-methoxyphenyl)-6-(4-methylsulfonylphenyl)-3a,4-dihydro-1,3-benzodioxole Traditional Name: 6-(4-mesylphenyl)-2-(3-methoxyphenyl)-3a,4-dihydro-1,3-benzodioxole Formula: C21H20O5S MolecularWeight: 384.4455

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2OC3CC=C(C=C3O2)C4=CC=C(C=C4)S(=O)(=O)C

Isomeric SMILES

COC1=CC=CC(=C1)C2OC3CC=C(C=C3O2)C4=CC=C(C=C4)S(=O)(=O)C

InChI

InChI=1S/C21H20O5S/c1-24-17-5-3-4-16(12-17)21-25-19-11-8-15(13-20(19)26-21)14-6-9-18(10-7-14)27(2,22)23/h3-10,12-13,19,21H,11H2,1-2H3