6-azanyl-3-(furan-2-ylmethyl)-2-(trifluoromethyl)-4aH-quinazolin-3-ium-4-one

Systemtic Name: 6-azanyl-3-(furan-2-ylmethyl)-2-(trifluoromethyl)-4aH-quinazolin-3-ium-4-one Openeye Name: 6-amino-3-(2-furylmethyl)-2-(trifluoromethyl)-4aH-quinazolin-3-ium-4-one CAS Name: 6-amino-3-(2-furanylmethyl)-2-(trifluoromethyl)-4aH-quinazolin-3-ium-4-one IUPAC Name: 6-amino-3-(furan-2-ylmethyl)-2-(trifluoromethyl)-4aH-quinazolin-3-ium-4-one Traditional Name: 6-amino-3-(2-furfuryl)-2-(trifluoromethyl)-4aH-quinazolin-3-ium-4-one Formula: C14H11F3N3O2+ MolecularWeight: 310.25125

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)C[N+]2=C(N=C3C=CC(=CC3C2=O)N)C(F)(F)F

Isomeric SMILES

C1=COC(=C1)C[N+]2=C(N=C3C=CC(=CC3C2=O)N)C(F)(F)F

InChI

InChI=1S/C14H11F3N3O2/c15-14(16,17)13-19-11-4-3-8(18)6-10(11)12(21)20(13)7-9-2-1-5-22-9/h1-6,10H,7,18H2/q+1