6-phenylhexyl 4-methylbenzenesulfonate

Systemtic Name: 6-phenylhexyl 4-methylbenzenesulfonate Openeye Name: 6-phenylhexyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 6-phenylhexyl ester IUPAC Name: 6-phenylhexyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 6-phenylhexyl ester Formula: C19H24O3S MolecularWeight: 332.45706

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCCCCCCC2=CC=CC=C2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCCCCCCC2=CC=CC=C2

InChI

InChI=1S/C19H24O3S/c1-17-12-14-19(15-13-17)23(20,21)22-16-8-3-2-5-9-18-10-6-4-7-11-18/h4,6-7,10-15H,2-3,5,8-9,16H2,1H3