[1-(4-fluorophenyl)carbonylpyrrolidin-1-ium-1-yl]methyl methanesulfonate

Systemtic Name: [1-(4-fluorophenyl)carbonylpyrrolidin-1-ium-1-yl]methyl methanesulfonate Openeye Name: [1-(4-fluorobenzoyl)pyrrolidin-1-ium-1-yl]methyl methanesulfonate CAS Name: methanesulfonic acid [1-[(4-fluorophenyl)-oxomethyl]-1-pyrrolidin-1-iumyl]methyl ester IUPAC Name: [1-(4-fluorobenzoyl)pyrrolidin-1-ium-1-yl]methyl methanesulfonate Traditional Name: methanesulfonic acid [1-(4-fluorobenzoyl)pyrrolidin-1-ium-1-yl]methyl ester Formula: C13H17FNO4S+ MolecularWeight: 302.341783

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OC[N+]1(CCCC1)C(=O)C2=CC=C(C=C2)F

Isomeric SMILES

CS(=O)(=O)OC[N+]1(CCCC1)C(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C13H17FNO4S/c1-20(17,18)19-10-15(8-2-3-9-15)13(16)11-4-6-12(14)7-5-11/h4-7H,2-3,8-10H2,1H3/q+1