dimethyl 2-[(Z)-4-acetyloxybut-2-enyl]-2-[2-(4-methylphenyl)sulfonylbut-3-enyl]propanedioate

Systemtic Name: dimethyl 2-[(Z)-4-acetyloxybut-2-enyl]-2-[2-(4-methylphenyl)sulfonylbut-3-enyl]propanedioate Openeye Name: dimethyl 2-[(Z)-4-acetoxybut-2-enyl]-2-[2-(p-tolylsulfonyl)but-3-enyl]propanedioate CAS Name: 2-[(Z)-4-acetyloxybut-2-enyl]-2-[2-(4-methylphenyl)sulfonylbut-3-enyl]propanedioic acid dimethyl ester IUPAC Name: dimethyl 2-[(Z)-4-acetyloxybut-2-enyl]-2-[2-(4-methylphenyl)sulfonylbut-3-enyl]propanedioate Traditional Name: 2-[(Z)-4-acetoxybut-2-enyl]-2-(2-tosylbut-3-enyl)malonic acid dimethyl ester Formula: C22H28O8S MolecularWeight: 452.51792

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C(CC(CC=CCOC(=O)C)(C(=O)OC)C(=O)OC)C=C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C(CC(C/C=C\COC(=O)C)(C(=O)OC)C(=O)OC)C=C

InChI

InChI=1S/C22H28O8S/c1-6-18(31(26,27)19-11-9-16(2)10-12-19)15-22(20(24)28-4,21(25)29-5)13-7-8-14-30-17(3)23/h6-12,18H,1,13-15H2,2-5H3/b8-7-