(6-methanoyl-4-methyl-1,3-benzodioxol-5-yl) 4-methylbenzenesulfonate

Systemtic Name: (6-methanoyl-4-methyl-1,3-benzodioxol-5-yl) 4-methylbenzenesulfonate Openeye Name: (6-formyl-4-methyl-1,3-benzodioxol-5-yl) 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid (6-formyl-4-methyl-1,3-benzodioxol-5-yl) ester IUPAC Name: (6-formyl-4-methyl-1,3-benzodioxol-5-yl) 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (6-formyl-4-methyl-1,3-benzodioxol-5-yl) ester Formula: C16H14O6S MolecularWeight: 334.34376

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=C(C3=C(C=C2C=O)OCO3)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=C(C3=C(C=C2C=O)OCO3)C

InChI

InChI=1S/C16H14O6S/c1-10-3-5-13(6-4-10)23(18,19)22-15-11(2)16-14(20-9-21-16)7-12(15)8-17/h3-8H,9H2,1-2H3