2-[3-(4-dimethylaminophenyl)-5-(trifluoromethyl)-1H-pyrazol-4-yl]ethylazanium

Systemtic Name: 2-[3-(4-dimethylaminophenyl)-5-(trifluoromethyl)-1H-pyrazol-4-yl]ethylazanium Openeye Name: 2-[3-(4-dimethylaminophenyl)-5-(trifluoromethyl)-1H-pyrazol-4-yl]ethylammonium CAS Name: 2-[3-(4-dimethylaminophenyl)-5-(trifluoromethyl)-1H-pyrazol-4-yl]ethylammonium IUPAC Name: 2-[3-(4-dimethylaminophenyl)-5-(trifluoromethyl)-1H-pyrazol-4-yl]ethylazanium Traditional Name: 2-[3-(4-dimethylaminophenyl)-5-(trifluoromethyl)-1H-pyrazol-4-yl]ethylammonium Formula: C14H18F3N4+ MolecularWeight: 299.31473

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C2=NNC(=C2CC[NH3+])C(F)(F)F

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C2=NNC(=C2CC[NH3+])C(F)(F)F

InChI

InChI=1S/C14H17F3N4/c1-21(2)10-5-3-9(4-6-10)12-11(7-8-18)13(20-19-12)14(15,16)17/h3-6H,7-8,18H2,1-2H3,(H,19,20)/p+1