hex-5-ynyl phenylmethanesulfonate

Systemtic Name: hex-5-ynyl phenylmethanesulfonate Openeye Name: hex-5-ynyl phenylmethanesulfonate CAS Name: phenylmethanesulfonic acid hex-5-ynyl ester IUPAC Name: hex-5-ynyl phenylmethanesulfonate Traditional Name: phenylmethanesulfonic acid hex-5-ynyl ester Formula: C13H16O3S MolecularWeight: 252.32934

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Descriptors Computed from Structure

Canonical SMILES:

C#CCCCCOS(=O)(=O)CC1=CC=CC=C1

Isomeric SMILES

C#CCCCCOS(=O)(=O)CC1=CC=CC=C1

InChI

InChI=1S/C13H16O3S/c1-2-3-4-8-11-16-17(14,15)12-13-9-6-5-7-10-13/h1,5-7,9-10H,3-4,8,11-12H2