tetratriacontan-17-yl 4-methylbenzenesulfonate

Systemtic Name: tetratriacontan-17-yl 4-methylbenzenesulfonate Openeye Name: 1-hexadecyloctadecyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid tetratriacontan-17-yl ester IUPAC Name: tetratriacontan-17-yl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 1-cetyloctadecyl ester Formula: C41H76O3S MolecularWeight: 649.10534

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(CCCCCCCCCCCCCCCC)OS(=O)(=O)C1=CC=C(C=C1)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(CCCCCCCCCCCCCCCC)OS(=O)(=O)C1=CC=C(C=C1)C

InChI

InChI=1S/C41H76O3S/c1-4-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-40(44-45(42,43)41-37-35-39(3)36-38-41)33-31-29-27-25-23-21-19-17-15-13-11-9-7-5-2/h35-38,40H,4-34H2,1-3H3