[2,3-dimethyl-4-[(4-methylphenyl)sulfonyloxymethyl]cyclobut-2-en-1-yl]methyl 4-methylbenzenesulfonate

Systemtic Name: [2,3-dimethyl-4-[(4-methylphenyl)sulfonyloxymethyl]cyclobut-2-en-1-yl]methyl 4-methylbenzenesulfonate Openeye Name: [2,3-dimethyl-4-(p-tolylsulfonyloxymethyl)cyclobut-2-en-1-yl]methyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [2,3-dimethyl-4-[(4-methylphenyl)sulfonyloxymethyl]-1-cyclobut-2-enyl]methyl ester IUPAC Name: [2,3-dimethyl-4-[(4-methylphenyl)sulfonyloxymethyl]cyclobut-2-en-1-yl]methyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [2,3-dimethyl-4-(tosyloxymethyl)cyclobut-2-en-1-yl]methyl ester Formula: C22H26O6S2 MolecularWeight: 450.56824

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCC2C(C(=C2C)C)COS(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCC2C(C(=C2C)C)COS(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C22H26O6S2/c1-15-5-9-19(10-6-15)29(23,24)27-13-21-17(3)18(4)22(21)14-28-30(25,26)20-11-7-16(2)8-12-20/h5-12,21-22H,13-14H2,1-4H3