(13-methyl-15-oxidanylidene-pentadecyl) 4-methylbenzenesulfonate

Systemtic Name: (13-methyl-15-oxidanylidene-pentadecyl) 4-methylbenzenesulfonate Openeye Name: (13-methyl-15-oxo-pentadecyl) 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid (13-methyl-15-oxopentadecyl) ester IUPAC Name: (13-methyl-15-oxopentadecyl) 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (15-keto-13-methyl-pentadecyl) ester Formula: C23H38O4S MolecularWeight: 410.61042

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCCCCCCCCCCCCC(C)CC=O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCCCCCCCCCCCCC(C)CC=O

InChI

InChI=1S/C23H38O4S/c1-21(18-19-24)13-11-9-7-5-3-4-6-8-10-12-20-27-28(25,26)23-16-14-22(2)15-17-23/h14-17,19,21H,3-13,18,20H2,1-2H3