1-(1,3-benzodioxol-5-yl)-3-(4-methylphenyl)sulfonyl-propan-1-one

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-3-(4-methylphenyl)sulfonyl-propan-1-one Openeye Name: 1-(1,3-benzodioxol-5-yl)-3-(p-tolylsulfonyl)propan-1-one CAS Name: 1-(1,3-benzodioxol-5-yl)-3-(4-methylphenyl)sulfonyl-1-propanone IUPAC Name: 1-(1,3-benzodioxol-5-yl)-3-(4-methylphenyl)sulfonylpropan-1-one Traditional Name: 1-(1,3-benzodioxol-5-yl)-3-tosyl-propan-1-one Formula: C17H16O5S MolecularWeight: 332.37094

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CCC(=O)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CCC(=O)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C17H16O5S/c1-12-2-5-14(6-3-12)23(19,20)9-8-15(18)13-4-7-16-17(10-13)22-11-21-16/h2-7,10H,8-9,11H2,1H3