[(E)-3,7,9-trimethyldec-6-enyl] 4-methylbenzenesulfonate

Systemtic Name: [(E)-3,7,9-trimethyldec-6-enyl] 4-methylbenzenesulfonate Openeye Name: [(E)-3,7,9-trimethyldec-6-enyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [(E)-3,7,9-trimethyldec-6-enyl] ester IUPAC Name: [(E)-3,7,9-trimethyldec-6-enyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [(E)-3,7,9-trimethyldec-6-enyl] ester Formula: C20H32O3S MolecularWeight: 352.53128

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCCC(C)CCC=C(C)CC(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCCC(C)CC/C=C(\C)/CC(C)C

InChI

InChI=1S/C20H32O3S/c1-16(2)15-19(5)8-6-7-17(3)13-14-23-24(21,22)20-11-9-18(4)10-12-20/h8-12,16-17H,6-7,13-15H2,1-5H3/b19-8+