(5-cyclopropyl-2-phenyl-pyrazol-3-yl)-[4-[5-(trifluoromethyl)pyridin-1-ium-2-yl]piperazin-1-yl]methanone

Systemtic Name: (5-cyclopropyl-2-phenyl-pyrazol-3-yl)-[4-[5-(trifluoromethyl)pyridin-1-ium-2-yl]piperazin-1-yl]methanone Openeye Name: (5-cyclopropyl-2-phenyl-pyrazol-3-yl)-[4-[5-(trifluoromethyl)pyridin-1-ium-2-yl]piperazin-1-yl]methanone CAS Name: (5-cyclopropyl-2-phenyl-3-pyrazolyl)-[4-[5-(trifluoromethyl)-2-pyridin-1-iumyl]-1-piperazinyl]methanone IUPAC Name: (5-cyclopropyl-2-phenylpyrazol-3-yl)-[4-[5-(trifluoromethyl)pyridin-1-ium-2-yl]piperazin-1-yl]methanone Traditional Name: (5-cyclopropyl-2-phenyl-pyrazol-3-yl)-[4-[5-(trifluoromethyl)pyridin-1-ium-2-yl]piperazino]methanone Formula: C23H23F3N5O+ MolecularWeight: 442.45683

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NN(C(=C2)C(=O)N3CCN(CC3)C4=[NH+]C=C(C=C4)C(F)(F)F)C5=CC=CC=C5

Isomeric SMILES

C1CC1C2=NN(C(=C2)C(=O)N3CCN(CC3)C4=[NH+]C=C(C=C4)C(F)(F)F)C5=CC=CC=C5

InChI

InChI=1S/C23H22F3N5O/c24-23(25,26)17-8-9-21(27-15-17)29-10-12-30(13-11-29)22(32)20-14-19(16-6-7-16)28-31(20)18-4-2-1-3-5-18/h1-5,8-9,14-16H,6-7,10-13H2/p+1