ethyl-[[4-oxidanylidene-7-(trifluoromethyl)-1H-quinazolin-2-yl]methyl]-(phenylmethyl)azanium

Systemtic Name: ethyl-[[4-oxidanylidene-7-(trifluoromethyl)-1H-quinazolin-2-yl]methyl]-(phenylmethyl)azanium Openeye Name: benzyl-ethyl-[[4-oxo-7-(trifluoromethyl)-1H-quinazolin-2-yl]methyl]ammonium CAS Name: ethyl-[[4-oxo-7-(trifluoromethyl)-1H-quinazolin-2-yl]methyl]-(phenylmethyl)ammonium IUPAC Name: benzyl-ethyl-[[4-oxo-7-(trifluoromethyl)-1H-quinazolin-2-yl]methyl]azanium Traditional Name: benzyl-ethyl-[[4-keto-7-(trifluoromethyl)-1H-quinazolin-2-yl]methyl]ammonium Formula: C19H19F3N3O+ MolecularWeight: 362.36887

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC1=CC=CC=C1)CC2=NC(=O)C3=C(N2)C=C(C=C3)C(F)(F)F

Isomeric SMILES

CC[NH+](CC1=CC=CC=C1)CC2=NC(=O)C3=C(N2)C=C(C=C3)C(F)(F)F

InChI

InChI=1S/C19H18F3N3O/c1-2-25(11-13-6-4-3-5-7-13)12-17-23-16-10-14(19(20,21)22)8-9-15(16)18(26)24-17/h3-10H,2,11-12H2,1H3,(H,23,24,26)/p+1