4-methylpent-1-en-3-yl 4-methylbenzenesulfonate

Systemtic Name: 4-methylpent-1-en-3-yl 4-methylbenzenesulfonate Openeye Name: 1-isopropylallyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 4-methylpent-1-en-3-yl ester IUPAC Name: 4-methylpent-1-en-3-yl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 1-isopropylallyl ester Formula: C13H18O3S MolecularWeight: 254.34522

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18O3S/c1-5-13(10(2)3)16-17(14,15)12-8-6-11(4)7-9-12/h5-10,13H,1H2,2-4H3