3-chloranyl-N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-5-(trifluoromethyl)pyridin-1-ium-2-amine

Systemtic Name: 3-chloranyl-N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-5-(trifluoromethyl)pyridin-1-ium-2-amine Openeye Name: 3-chloro-N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-5-(trifluoromethyl)pyridin-1-ium-2-amine CAS Name: 3-chloro-N-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)methyl]-5-(trifluoromethyl)-2-pyridin-1-iumamine IUPAC Name: 3-chloro-N-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methyl]-5-(trifluoromethyl)pyridin-1-ium-2-amine Traditional Name: [3-chloro-5-(trifluoromethyl)pyridin-1-ium-2-yl]-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]amine Formula: C18H17ClF3N4+ MolecularWeight: 381.80259

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)CNC3=C(C=C(C=[NH+]3)C(F)(F)F)Cl

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)CNC3=C(C=C(C=[NH+]3)C(F)(F)F)Cl

InChI

InChI=1S/C18H16ClF3N4/c1-11-15(12(2)26(25-11)14-6-4-3-5-7-14)10-24-17-16(19)8-13(9-23-17)18(20,21)22/h3-9H,10H2,1-2H3,(H,23,24)/p+1