[4-oxidanylidene-7-(trifluoromethyl)-1H-quinazolin-2-yl]methyl 5-methylfuran-2-carboxylate

Systemtic Name: [4-oxidanylidene-7-(trifluoromethyl)-1H-quinazolin-2-yl]methyl 5-methylfuran-2-carboxylate Openeye Name: [4-oxo-7-(trifluoromethyl)-1H-quinazolin-2-yl]methyl 5-methylfuran-2-carboxylate CAS Name: 5-methyl-2-furancarboxylic acid [4-oxo-7-(trifluoromethyl)-1H-quinazolin-2-yl]methyl ester IUPAC Name: [4-oxo-7-(trifluoromethyl)-1H-quinazolin-2-yl]methyl 5-methylfuran-2-carboxylate Traditional Name: 5-methylfuran-2-carboxylic acid [4-keto-7-(trifluoromethyl)-1H-quinazolin-2-yl]methyl ester Formula: C16H11F3N2O4 MolecularWeight: 352.26475

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C(=O)OCC2=NC(=O)C3=C(N2)C=C(C=C3)C(F)(F)F

Isomeric SMILES

CC1=CC=C(O1)C(=O)OCC2=NC(=O)C3=C(N2)C=C(C=C3)C(F)(F)F

InChI

InChI=1S/C16H11F3N2O4/c1-8-2-5-12(25-8)15(23)24-7-13-20-11-6-9(16(17,18)19)3-4-10(11)14(22)21-13/h2-6H,7H2,1H3,(H,20,21,22)