methanesulfonate; prop-1-ynylbenzene

Systemtic Name: methanesulfonate; prop-1-ynylbenzene Openeye Name: methanesulfonate; prop-1-ynylbenzene CAS Name: methanesulfonate; prop-1-ynylbenzene IUPAC Name: methanesulfonate; prop-1-ynylbenzene Traditional Name: prop-1-ynylbenzene mesylate Formula: C10H11O3S- MolecularWeight: 211.25754

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Descriptors Computed from Structure

Canonical SMILES:

CC#CC1=CC=CC=C1.CS(=O)(=O)[O-]

Isomeric SMILES

CC#CC1=CC=CC=C1.CS(=O)(=O)[O-]

InChI

InChI=1S/C9H8.CH4O3S/c1-2-6-9-7-4-3-5-8-9;1-5(2,3)4/h3-5,7-8H,1H3;1H3,(H,2,3,4)/p-1