methyl (E,4S,5S)-4-(2,4-dimethylphenyl)-5-(4-methylphenyl)sulfonyloxy-hex-2-enoate

Systemtic Name: methyl (E,4S,5S)-4-(2,4-dimethylphenyl)-5-(4-methylphenyl)sulfonyloxy-hex-2-enoate Openeye Name: methyl (E,4S,5S)-4-(2,4-dimethylphenyl)-5-(p-tolylsulfonyloxy)hex-2-enoate CAS Name: (E,4S,5S)-4-(2,4-dimethylphenyl)-5-(4-methylphenyl)sulfonyloxy-2-hexenoic acid methyl ester IUPAC Name: methyl (E,4S,5S)-4-(2,4-dimethylphenyl)-5-(4-methylphenyl)sulfonyloxyhex-2-enoate Traditional Name: (E,4S,5S)-4-(2,4-dimethylphenyl)-5-tosyloxy-hex-2-enoic acid methyl ester Formula: C22H26O5S MolecularWeight: 402.50384

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC(C)C(C=CC(=O)OC)C2=C(C=C(C=C2)C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)O[C@@H](C)[C@@H](/C=C/C(=O)OC)C2=C(C=C(C=C2)C)C

InChI

InChI=1S/C22H26O5S/c1-15-6-9-19(10-7-15)28(24,25)27-18(4)21(12-13-22(23)26-5)20-11-8-16(2)14-17(20)3/h6-14,18,21H,1-5H3/b13-12+/t18-,21+/m0/s1