[4-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]phenyl]methylazanium

Systemtic Name: [4-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]phenyl]methylazanium Openeye Name: [4-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]phenyl]methylammonium CAS Name: [4-[5-methyl-3-(trifluoromethyl)-1-pyrazolyl]phenyl]methylammonium IUPAC Name: [4-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]phenyl]methylazanium Traditional Name: [4-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]benzyl]ammonium Formula: C12H13F3N3+ MolecularWeight: 256.24693

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=CC=C(C=C2)C[NH3+])C(F)(F)F

Isomeric SMILES

CC1=CC(=NN1C2=CC=C(C=C2)C[NH3+])C(F)(F)F

InChI

InChI=1S/C12H12F3N3/c1-8-6-11(12(13,14)15)17-18(8)10-4-2-9(7-16)3-5-10/h2-6H,7,16H2,1H3/p+1