2-methylpent-4-enyl 4-methylbenzenesulfonate

Systemtic Name: 2-methylpent-4-enyl 4-methylbenzenesulfonate Openeye Name: 2-methylpent-4-enyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 2-methylpent-4-enyl ester IUPAC Name: 2-methylpent-4-enyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 2-methylpent-4-enyl ester Formula: C13H18O3S MolecularWeight: 254.34522

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCC(C)CC=C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCC(C)CC=C

InChI

InChI=1S/C13H18O3S/c1-4-5-12(3)10-16-17(14,15)13-8-6-11(2)7-9-13/h4,6-9,12H,1,5,10H2,2-3H3