tert-butyl 2-hexyl-5-(4-methylphenyl)sulfonyl-benzoate

Systemtic Name: tert-butyl 2-hexyl-5-(4-methylphenyl)sulfonyl-benzoate Openeye Name: tert-butyl 2-hexyl-5-(p-tolylsulfonyl)benzoate CAS Name: 2-hexyl-5-(4-methylphenyl)sulfonylbenzoic acid tert-butyl ester IUPAC Name: tert-butyl 2-hexyl-5-(4-methylphenyl)sulfonylbenzoate Traditional Name: 2-hexyl-5-tosyl-benzoic acid tert-butyl ester Formula: C24H32O4S MolecularWeight: 416.57348

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(C=C(C=C1)S(=O)(=O)C2=CC=C(C=C2)C)C(=O)OC(C)(C)C

Isomeric SMILES

CCCCCCC1=C(C=C(C=C1)S(=O)(=O)C2=CC=C(C=C2)C)C(=O)OC(C)(C)C

InChI

InChI=1S/C24H32O4S/c1-6-7-8-9-10-19-13-16-21(17-22(19)23(25)28-24(3,4)5)29(26,27)20-14-11-18(2)12-15-20/h11-17H,6-10H2,1-5H3