(5-methanoyl-6-phenylmethoxy-2,3-dihydro-1,4-benzodioxin-3-yl)methyl 4-methylbenzenesulfonate

Systemtic Name: (5-methanoyl-6-phenylmethoxy-2,3-dihydro-1,4-benzodioxin-3-yl)methyl 4-methylbenzenesulfonate Openeye Name: (6-benzyloxy-5-formyl-2,3-dihydro-1,4-benzodioxin-3-yl)methyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid (5-formyl-6-phenylmethoxy-2,3-dihydro-1,4-benzodioxin-3-yl)methyl ester IUPAC Name: (5-formyl-6-phenylmethoxy-2,3-dihydro-1,4-benzodioxin-3-yl)methyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (6-benzoxy-5-formyl-2,3-dihydro-1,4-benzodioxin-3-yl)methyl ester Formula: C24H22O7S MolecularWeight: 454.49228

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCC2COC3=C(O2)C(=C(C=C3)OCC4=CC=CC=C4)C=O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCC2COC3=C(O2)C(=C(C=C3)OCC4=CC=CC=C4)C=O

InChI

InChI=1S/C24H22O7S/c1-17-7-9-20(10-8-17)32(26,27)30-16-19-15-29-23-12-11-22(21(13-25)24(23)31-19)28-14-18-5-3-2-4-6-18/h2-13,19H,14-16H2,1H3