2-[2-[3-[bis(fluoranyl)methyl]-5-cyclopropyl-pyrazol-1-yl]ethanoylamino]ethyl-dimethyl-azanium

Systemtic Name: 2-[2-[3-[bis(fluoranyl)methyl]-5-cyclopropyl-pyrazol-1-yl]ethanoylamino]ethyl-dimethyl-azanium Openeye Name: 2-[[2-[5-cyclopropyl-3-(difluoromethyl)pyrazol-1-yl]acetyl]amino]ethyl-dimethyl-ammonium CAS Name: 2-[[2-[5-cyclopropyl-3-(difluoromethyl)-1-pyrazolyl]-1-oxoethyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[[2-[5-cyclopropyl-3-(difluoromethyl)pyrazol-1-yl]acetyl]amino]ethyl-dimethylazanium Traditional Name: 2-[[2-[5-cyclopropyl-3-(difluoromethyl)pyrazol-1-yl]acetyl]amino]ethyl-dimethyl-ammonium Formula: C13H21F2N4O+ MolecularWeight: 287.328846

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCNC(=O)CN1C(=CC(=N1)C(F)F)C2CC2

Isomeric SMILES

C[NH+](C)CCNC(=O)CN1C(=CC(=N1)C(F)F)C2CC2

InChI

InChI=1S/C13H20F2N4O/c1-18(2)6-5-16-12(20)8-19-11(9-3-4-9)7-10(17-19)13(14)15/h7,9,13H,3-6,8H2,1-2H3,(H,16,20)/p+1