2-[[5-ethyl-1-(3-fluorophenyl)pyrazol-4-yl]carbonylamino]ethyl-dimethyl-azanium

Systemtic Name: 2-[[5-ethyl-1-(3-fluorophenyl)pyrazol-4-yl]carbonylamino]ethyl-dimethyl-azanium Openeye Name: 2-[[5-ethyl-1-(3-fluorophenyl)pyrazole-4-carbonyl]amino]ethyl-dimethyl-ammonium CAS Name: 2-[[[5-ethyl-1-(3-fluorophenyl)-4-pyrazolyl]-oxomethyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[[5-ethyl-1-(3-fluorophenyl)pyrazole-4-carbonyl]amino]ethyl-dimethylazanium Traditional Name: 2-[[5-ethyl-1-(3-fluorophenyl)pyrazole-4-carbonyl]amino]ethyl-dimethyl-ammonium Formula: C16H22FN4O+ MolecularWeight: 305.370483

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=NN1C2=CC(=CC=C2)F)C(=O)NCC[NH+](C)C

Isomeric SMILES

CCC1=C(C=NN1C2=CC(=CC=C2)F)C(=O)NCC[NH+](C)C

InChI

InChI=1S/C16H21FN4O/c1-4-15-14(16(22)18-8-9-20(2)3)11-19-21(15)13-7-5-6-12(17)10-13/h5-7,10-11H,4,8-9H2,1-3H3,(H,18,22)/p+1