oct-7-ynyl 4-methylbenzenesulfonate

Systemtic Name: oct-7-ynyl 4-methylbenzenesulfonate Openeye Name: oct-7-ynyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid oct-7-ynyl ester IUPAC Name: oct-7-ynyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid oct-7-ynyl ester Formula: C15H20O3S MolecularWeight: 280.3825

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCCCCCCC#C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCCCCCCC#C

InChI

InChI=1S/C15H20O3S/c1-3-4-5-6-7-8-13-18-19(16,17)15-11-9-14(2)10-12-15/h1,9-12H,4-8,13H2,2H3