4-(4-pyridin-1-ium-4-ylpiperazin-1-yl)-2-(trifluoromethyl)quinazoline

Systemtic Name: 4-(4-pyridin-1-ium-4-ylpiperazin-1-yl)-2-(trifluoromethyl)quinazoline Openeye Name: 4-(4-pyridin-1-ium-4-ylpiperazin-1-yl)-2-(trifluoromethyl)quinazoline CAS Name: 4-[4-(4-pyridin-1-iumyl)-1-piperazinyl]-2-(trifluoromethyl)quinazoline IUPAC Name: 4-(4-pyridin-1-ium-4-ylpiperazin-1-yl)-2-(trifluoromethyl)quinazoline Traditional Name: 4-(4-pyridin-1-ium-4-ylpiperazino)-2-(trifluoromethyl)quinazoline Formula: C18H17F3N5+ MolecularWeight: 360.35629

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=[NH+]C=C2)C3=NC(=NC4=CC=CC=C43)C(F)(F)F

Isomeric SMILES

C1CN(CCN1C2=CC=[NH+]C=C2)C3=NC(=NC4=CC=CC=C43)C(F)(F)F

InChI

InChI=1S/C18H16F3N5/c19-18(20,21)17-23-15-4-2-1-3-14(15)16(24-17)26-11-9-25(10-12-26)13-5-7-22-8-6-13/h1-8H,9-12H2/p+1