tert-butyl 16-(4-methylphenyl)sulfinylhexadecanoate

Systemtic Name: tert-butyl 16-(4-methylphenyl)sulfinylhexadecanoate Openeye Name: tert-butyl 16-(p-tolylsulfinyl)hexadecanoate CAS Name: 16-(4-methylphenyl)sulfinylhexadecanoic acid tert-butyl ester IUPAC Name: tert-butyl 16-(4-methylphenyl)sulfinylhexadecanoate Traditional Name: 16-(p-tolylsulfinyl)palmitic acid tert-butyl ester Formula: C27H46O3S MolecularWeight: 450.71734

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H46O3S/c1-24-19-21-25(22-20-24)31(29)23-17-15-13-11-9-7-5-6-8-10-12-14-16-18-26(28)30-27(2,3)4/h19-22H,5-18,23H2,1-4H3