hex-5-en-2-ynyl 4-methylbenzenesulfonate

Systemtic Name: hex-5-en-2-ynyl 4-methylbenzenesulfonate Openeye Name: hex-5-en-2-ynyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid hex-5-en-2-ynyl ester IUPAC Name: hex-5-en-2-ynyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid hex-5-en-2-ynyl ester Formula: C13H14O3S MolecularWeight: 250.31346

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H14O3S/c1-3-4-5-6-11-16-17(14,15)13-9-7-12(2)8-10-13/h3,7-10H,1,4,11H2,2H3