[1-(4-oxidanyl-3,6-dioxabicyclo[3.1.0]hexan-2-yl)-2-phenylmethoxy-ethyl] 4-methylbenzenesulfonate

Systemtic Name: [1-(4-oxidanyl-3,6-dioxabicyclo[3.1.0]hexan-2-yl)-2-phenylmethoxy-ethyl] 4-methylbenzenesulfonate Openeye Name: [2-benzyloxy-1-(4-hydroxy-3,6-dioxabicyclo[3.1.0]hexan-2-yl)ethyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [1-(4-hydroxy-3,6-dioxabicyclo[3.1.0]hexan-2-yl)-2-phenylmethoxyethyl] ester IUPAC Name: [1-(4-hydroxy-3,6-dioxabicyclo[3.1.0]hexan-2-yl)-2-phenylmethoxyethyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [2-benzoxy-1-(4-hydroxy-3,6-dioxabicyclo[3.1.0]hexan-2-yl)ethyl] ester Formula: C20H22O7S MolecularWeight: 406.44948

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC(COCC2=CC=CC=C2)C3C4C(O4)C(O3)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC(COCC2=CC=CC=C2)C3C4C(O4)C(O3)O

InChI

InChI=1S/C20H22O7S/c1-13-7-9-15(10-8-13)28(22,23)27-16(17-18-19(25-18)20(21)26-17)12-24-11-14-5-3-2-4-6-14/h2-10,16-21H,11-12H2,1H3