1,3-benzodioxol-5-yl 3-(phenylsulfonylmethyl)benzoate

Systemtic Name: 1,3-benzodioxol-5-yl 3-(phenylsulfonylmethyl)benzoate Openeye Name: 1,3-benzodioxol-5-yl 3-(benzenesulfonylmethyl)benzoate CAS Name: 3-(benzenesulfonylmethyl)benzoic acid 1,3-benzodioxol-5-yl ester IUPAC Name: 1,3-benzodioxol-5-yl 3-(benzenesulfonylmethyl)benzoate Traditional Name: 3-(besylmethyl)benzoic acid 1,3-benzodioxol-5-yl ester Formula: C21H16O6S MolecularWeight: 396.41314

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)OC(=O)C3=CC(=CC=C3)CS(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)OC(=O)C3=CC(=CC=C3)CS(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C21H16O6S/c22-21(27-17-9-10-19-20(12-17)26-14-25-19)16-6-4-5-15(11-16)13-28(23,24)18-7-2-1-3-8-18/h1-12H,13-14H2