4-(4-hexylphenyl)butyl 4-methylbenzenesulfonate

Systemtic Name: 4-(4-hexylphenyl)butyl 4-methylbenzenesulfonate Openeye Name: 4-(4-hexylphenyl)butyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 4-(4-hexylphenyl)butyl ester IUPAC Name: 4-(4-hexylphenyl)butyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 4-(4-hexylphenyl)butyl ester Formula: C23H32O3S MolecularWeight: 388.56338

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)CCCCOS(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCCCCCC1=CC=C(C=C1)CCCCOS(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C23H32O3S/c1-3-4-5-6-9-21-13-15-22(16-14-21)10-7-8-19-26-27(24,25)23-17-11-20(2)12-18-23/h11-18H,3-10,19H2,1-2H3