[(E)-11-phenylundec-9-enyl] 4-methylbenzenesulfonate

Systemtic Name: [(E)-11-phenylundec-9-enyl] 4-methylbenzenesulfonate Openeye Name: [(E)-11-phenylundec-9-enyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [(E)-11-phenylundec-9-enyl] ester IUPAC Name: [(E)-11-phenylundec-9-enyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [(E)-11-phenylundec-9-enyl] ester Formula: C24H32O3S MolecularWeight: 400.57408

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCCCCCCCCC=CCC2=CC=CC=C2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCCCCCCCC/C=C/CC2=CC=CC=C2

InChI

InChI=1S/C24H32O3S/c1-22-17-19-24(20-18-22)28(25,26)27-21-13-8-6-4-2-3-5-7-10-14-23-15-11-9-12-16-23/h7,9-12,15-20H,2-6,8,13-14,21H2,1H3/b10-7+