tert-butyl (5E,7E)-14-(4-methylphenyl)sulfinyltetradeca-5,7-dienoate

Systemtic Name: tert-butyl (5E,7E)-14-(4-methylphenyl)sulfinyltetradeca-5,7-dienoate Openeye Name: tert-butyl (5E,7E)-14-(p-tolylsulfinyl)tetradeca-5,7-dienoate CAS Name: (5E,7E)-14-(4-methylphenyl)sulfinyltetradeca-5,7-dienoic acid tert-butyl ester IUPAC Name: tert-butyl (5E,7E)-14-(4-methylphenyl)sulfinyltetradeca-5,7-dienoate Traditional Name: (5E,7E)-14-(p-tolylsulfinyl)tetradeca-5,7-dienoic acid tert-butyl ester Formula: C25H38O3S MolecularWeight: 418.63242

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)CCCCCCC=CC=CCCCC(=O)OC(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)CCCCCC/C=C/C=C/CCCC(=O)OC(C)(C)C

InChI

InChI=1S/C25H38O3S/c1-22-17-19-23(20-18-22)29(27)21-15-13-11-9-7-5-6-8-10-12-14-16-24(26)28-25(2,3)4/h5-6,8,10,17-20H,7,9,11-16,21H2,1-4H3/b6-5+,10-8+