3-[[(3S)-1-(3-fluorophenyl)-5-oxidanylidene-pyrrolidin-3-yl]carbamoylamino]propyl-dimethyl-azanium

Systemtic Name: 3-[[(3S)-1-(3-fluorophenyl)-5-oxidanylidene-pyrrolidin-3-yl]carbamoylamino]propyl-dimethyl-azanium Openeye Name: 3-[[(3S)-1-(3-fluorophenyl)-5-oxo-pyrrolidin-3-yl]carbamoylamino]propyl-dimethyl-ammonium CAS Name: 3-[[[[(3S)-1-(3-fluorophenyl)-5-oxo-3-pyrrolidinyl]amino]-oxomethyl]amino]propyl-dimethylammonium IUPAC Name: 3-[[(3S)-1-(3-fluorophenyl)-5-oxopyrrolidin-3-yl]carbamoylamino]propyl-dimethylazanium Traditional Name: 3-[[(3S)-1-(3-fluorophenyl)-5-keto-pyrrolidin-3-yl]carbamoylamino]propyl-dimethyl-ammonium Formula: C16H24FN4O2+ MolecularWeight: 323.385763

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCNC(=O)NC1CC(=O)N(C1)C2=CC(=CC=C2)F

Isomeric SMILES

C[NH+](C)CCCNC(=O)N[C@H]1CC(=O)N(C1)C2=CC(=CC=C2)F

InChI

InChI=1S/C16H23FN4O2/c1-20(2)8-4-7-18-16(23)19-13-10-15(22)21(11-13)14-6-3-5-12(17)9-14/h3,5-6,9,13H,4,7-8,10-11H2,1-2H3,(H2,18,19,23)/p+1/t13-/m0/s1