3-[(4-methylphenyl)sulfonyloxymethyl]-2,3-dihydro-1,4-benzodioxine-5-carboxylic acid

Systemtic Name: 3-[(4-methylphenyl)sulfonyloxymethyl]-2,3-dihydro-1,4-benzodioxine-5-carboxylic acid Openeye Name: 3-(p-tolylsulfonyloxymethyl)-2,3-dihydro-1,4-benzodioxine-5-carboxylic acid CAS Name: 3-[(4-methylphenyl)sulfonyloxymethyl]-2,3-dihydro-1,4-benzodioxin-5-carboxylic acid IUPAC Name: 3-[(4-methylphenyl)sulfonyloxymethyl]-2,3-dihydro-1,4-benzodioxine-5-carboxylic acid Traditional Name: 3-(tosyloxymethyl)-2,3-dihydro-1,4-benzodioxin-5-carboxylic acid Formula: C17H16O7S MolecularWeight: 364.36974

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCC2COC3=CC=CC(=C3O2)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCC2COC3=CC=CC(=C3O2)C(=O)O

InChI

InChI=1S/C17H16O7S/c1-11-5-7-13(8-6-11)25(20,21)23-10-12-9-22-15-4-2-3-14(17(18)19)16(15)24-12/h2-8,12H,9-10H2,1H3,(H,18,19)