4-[4-[[(2R)-oxolan-2-yl]methyl]piperazin-4-ium-1-yl]-2-(trifluoromethyl)quinazoline

Systemtic Name: 4-[4-[[(2R)-oxolan-2-yl]methyl]piperazin-4-ium-1-yl]-2-(trifluoromethyl)quinazoline Openeye Name: 4-[4-[[(2R)-tetrahydrofuran-2-yl]methyl]piperazin-4-ium-1-yl]-2-(trifluoromethyl)quinazoline CAS Name: 4-[4-[[(2R)-2-oxolanyl]methyl]-1-piperazin-4-iumyl]-2-(trifluoromethyl)quinazoline IUPAC Name: 4-[4-[[(2R)-oxolan-2-yl]methyl]piperazin-4-ium-1-yl]-2-(trifluoromethyl)quinazoline Traditional Name: 4-[4-[[(2R)-tetrahydrofuran-2-yl]methyl]piperazin-4-ium-1-yl]-2-(trifluoromethyl)quinazoline Formula: C18H22F3N4O+ MolecularWeight: 367.38869

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)C[NH+]2CCN(CC2)C3=NC(=NC4=CC=CC=C43)C(F)(F)F

Isomeric SMILES

C1C[C@@H](OC1)C[NH+]2CCN(CC2)C3=NC(=NC4=CC=CC=C43)C(F)(F)F

InChI

InChI=1S/C18H21F3N4O/c19-18(20,21)17-22-15-6-2-1-5-14(15)16(23-17)25-9-7-24(8-10-25)12-13-4-3-11-26-13/h1-2,5-6,13H,3-4,7-12H2/p+1/t13-/m1/s1