1-phenylpent-2-ynyl methanesulfonate

Systemtic Name: 1-phenylpent-2-ynyl methanesulfonate Openeye Name: 1-phenylpent-2-ynyl methanesulfonate CAS Name: methanesulfonic acid 1-phenylpent-2-ynyl ester IUPAC Name: 1-phenylpent-2-ynyl methanesulfonate Traditional Name: methanesulfonic acid 1-phenylpent-2-ynyl ester Formula: C12H14O3S MolecularWeight: 238.30276

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Descriptors Computed from Structure

Canonical SMILES:

CCC#CC(C1=CC=CC=C1)OS(=O)(=O)C

Isomeric SMILES

CCC#CC(C1=CC=CC=C1)OS(=O)(=O)C

InChI

InChI=1S/C12H14O3S/c1-3-4-10-12(15-16(2,13)14)11-8-6-5-7-9-11/h5-9,12H,3H2,1-2H3