dimethyl 2-[(E)-4-acetyloxy-3-methyl-but-2-enyl]-2-[2-(4-methylphenyl)sulfonylbut-3-enyl]propanedioate

Systemtic Name: dimethyl 2-[(E)-4-acetyloxy-3-methyl-but-2-enyl]-2-[2-(4-methylphenyl)sulfonylbut-3-enyl]propanedioate Openeye Name: dimethyl 2-[(E)-4-acetoxy-3-methyl-but-2-enyl]-2-[2-(p-tolylsulfonyl)but-3-enyl]propanedioate CAS Name: 2-[(E)-4-acetyloxy-3-methylbut-2-enyl]-2-[2-(4-methylphenyl)sulfonylbut-3-enyl]propanedioic acid dimethyl ester IUPAC Name: dimethyl 2-[(E)-4-acetyloxy-3-methylbut-2-enyl]-2-[2-(4-methylphenyl)sulfonylbut-3-enyl]propanedioate Traditional Name: 2-[(E)-4-acetoxy-3-methyl-but-2-enyl]-2-(2-tosylbut-3-enyl)malonic acid dimethyl ester Formula: C23H30O8S MolecularWeight: 466.5445

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Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C23H30O8S/c1-7-19(32(27,28)20-10-8-16(2)9-11-20)14-23(21(25)29-5,22(26)30-6)13-12-17(3)15-31-18(4)24/h7-12,19H,1,13-15H2,2-6H3/b17-12+