methyl 7-oxidanyl-6-[2-(phenylsulfonyl)prop-2-enyl]-1,3-benzodioxole-5-carboxylate

Systemtic Name: methyl 7-oxidanyl-6-[2-(phenylsulfonyl)prop-2-enyl]-1,3-benzodioxole-5-carboxylate Openeye Name: methyl 6-[2-(benzenesulfonyl)allyl]-7-hydroxy-1,3-benzodioxole-5-carboxylate CAS Name: 6-[2-(benzenesulfonyl)prop-2-enyl]-7-hydroxy-1,3-benzodioxole-5-carboxylic acid methyl ester IUPAC Name: methyl 6-[2-(benzenesulfonyl)prop-2-enyl]-7-hydroxy-1,3-benzodioxole-5-carboxylate Traditional Name: 6-(2-besylallyl)-7-hydroxy-piperonylic acid methyl ester Formula: C18H16O7S MolecularWeight: 376.38044

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C(=C1CC(=C)S(=O)(=O)C3=CC=CC=C3)O)OCO2

Isomeric SMILES

COC(=O)C1=CC2=C(C(=C1CC(=C)S(=O)(=O)C3=CC=CC=C3)O)OCO2

InChI

InChI=1S/C18H16O7S/c1-11(26(21,22)12-6-4-3-5-7-12)8-13-14(18(20)23-2)9-15-17(16(13)19)25-10-24-15/h3-7,9,19H,1,8,10H2,2H3