4-methoxybut-2-ynyl 4-methylbenzenesulfonate

Systemtic Name: 4-methoxybut-2-ynyl 4-methylbenzenesulfonate Openeye Name: 4-methoxybut-2-ynyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 4-methoxybut-2-ynyl ester IUPAC Name: 4-methoxybut-2-ynyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 4-methoxybut-2-ynyl ester Formula: C12H14O4S MolecularWeight: 254.30216

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H14O4S/c1-11-5-7-12(8-6-11)17(13,14)16-10-4-3-9-15-2/h5-8H,9-10H2,1-2H3