2-(methoxymethyl)-3-phenyl-5-pyridin-1-ium-4-yl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine

Systemtic Name: 2-(methoxymethyl)-3-phenyl-5-pyridin-1-ium-4-yl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine Openeye Name: 2-(methoxymethyl)-3-phenyl-5-pyridin-1-ium-4-yl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine CAS Name: 2-(methoxymethyl)-3-phenyl-5-(4-pyridin-1-iumyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine IUPAC Name: 2-(methoxymethyl)-3-phenyl-5-pyridin-1-ium-4-yl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine Traditional Name: 2-(methoxymethyl)-3-phenyl-5-pyridin-1-ium-4-yl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine Formula: C20H14F3N4O+ MolecularWeight: 383.34657

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Descriptors Computed from Structure

Canonical SMILES:

COCC1=NN2C(=CC(=NC2=C1C3=CC=CC=C3)C4=CC=[N+]=C=C4)C(F)(F)F

Isomeric SMILES

COCC1=NN2C(=CC(=NC2=C1C3=CC=CC=C3)C4=CC=[N+]=C=C4)C(F)(F)F

InChI

InChI=1S/C20H14F3N4O/c1-28-12-16-18(14-5-3-2-4-6-14)19-25-15(13-7-9-24-10-8-13)11-17(20(21,22)23)27(19)26-16/h2-9,11H,12H2,1H3/q+1