[4-oxidanylidene-7-(trifluoromethyl)-1H-quinazolin-2-yl]methyl 4-(dimethylamino)benzoate

Systemtic Name: [4-oxidanylidene-7-(trifluoromethyl)-1H-quinazolin-2-yl]methyl 4-(dimethylamino)benzoate Openeye Name: [4-oxo-7-(trifluoromethyl)-1H-quinazolin-2-yl]methyl 4-(dimethylamino)benzoate CAS Name: 4-(dimethylamino)benzoic acid [4-oxo-7-(trifluoromethyl)-1H-quinazolin-2-yl]methyl ester IUPAC Name: [4-oxo-7-(trifluoromethyl)-1H-quinazolin-2-yl]methyl 4-(dimethylamino)benzoate Traditional Name: 4-(dimethylamino)benzoic acid [4-keto-7-(trifluoromethyl)-1H-quinazolin-2-yl]methyl ester Formula: C19H16F3N3O3 MolecularWeight: 391.34385

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C(=O)OCC2=NC(=O)C3=C(N2)C=C(C=C3)C(F)(F)F

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C(=O)OCC2=NC(=O)C3=C(N2)C=C(C=C3)C(F)(F)F

InChI

InChI=1S/C19H16F3N3O3/c1-25(2)13-6-3-11(4-7-13)18(27)28-10-16-23-15-9-12(19(20,21)22)5-8-14(15)17(26)24-16/h3-9H,10H2,1-2H3,(H,23,24,26)