4-(2,4-dimethylphenyl)sulfonyloxybut-2-ynyl 2,4-dimethylbenzenesulfonate

Systemtic Name: 4-(2,4-dimethylphenyl)sulfonyloxybut-2-ynyl 2,4-dimethylbenzenesulfonate Openeye Name: 4-(2,4-dimethylphenyl)sulfonyloxybut-2-ynyl 2,4-dimethylbenzenesulfonate CAS Name: 2,4-dimethylbenzenesulfonic acid 4-(2,4-dimethylphenyl)sulfonyloxybut-2-ynyl ester IUPAC Name: 4-(2,4-dimethylphenyl)sulfonyloxybut-2-ynyl 2,4-dimethylbenzenesulfonate Traditional Name: 2,4-dimethylbenzenesulfonic acid 4-(2,4-dimethylphenyl)sulfonyloxybut-2-ynyl ester Formula: C20H22O6S2 MolecularWeight: 422.51508

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)S(=O)(=O)OCC#CCOS(=O)(=O)C2=C(C=C(C=C2)C)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)S(=O)(=O)OCC#CCOS(=O)(=O)C2=C(C=C(C=C2)C)C)C

InChI

InChI=1S/C20H22O6S2/c1-15-7-9-19(17(3)13-15)27(21,22)25-11-5-6-12-26-28(23,24)20-10-8-16(2)14-18(20)4/h7-10,13-14H,11-12H2,1-4H3