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

Systemtic Name: [5-(2-hydroxyethyl)-6-phenylmethoxy-2,3-dihydro-1,4-benzodioxin-3-yl]methyl 4-methylbenzenesulfonate Openeye Name: [6-benzyloxy-5-(2-hydroxyethyl)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [5-(2-hydroxyethyl)-6-phenylmethoxy-2,3-dihydro-1,4-benzodioxin-3-yl]methyl ester IUPAC Name: [5-(2-hydroxyethyl)-6-phenylmethoxy-2,3-dihydro-1,4-benzodioxin-3-yl]methyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [6-benzoxy-5-(2-hydroxyethyl)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl ester Formula: C25H26O7S MolecularWeight: 470.53474

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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)CCO

Isomeric SMILES

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

InChI

InChI=1S/C25H26O7S/c1-18-7-9-21(10-8-18)33(27,28)31-17-20-16-30-24-12-11-23(22(13-14-26)25(24)32-20)29-15-19-5-3-2-4-6-19/h2-12,20,26H,13-17H2,1H3