(4-oxidanylidene-1H-quinazolin-2-yl)methyl 6-(trifluoromethyl)pyridine-3-carboxylate

Systemtic Name: (4-oxidanylidene-1H-quinazolin-2-yl)methyl 6-(trifluoromethyl)pyridine-3-carboxylate Openeye Name: (4-oxo-1H-quinazolin-2-yl)methyl 6-(trifluoromethyl)pyridine-3-carboxylate CAS Name: 6-(trifluoromethyl)-3-pyridinecarboxylic acid (4-oxo-1H-quinazolin-2-yl)methyl ester IUPAC Name: (4-oxo-1H-quinazolin-2-yl)methyl 6-(trifluoromethyl)pyridine-3-carboxylate Traditional Name: 6-(trifluoromethyl)nicotinic acid (4-keto-1H-quinazolin-2-yl)methyl ester Formula: C16H10F3N3O3 MolecularWeight: 349.26411

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N=C(N2)COC(=O)C3=CN=C(C=C3)C(F)(F)F

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N=C(N2)COC(=O)C3=CN=C(C=C3)C(F)(F)F

InChI

InChI=1S/C16H10F3N3O3/c17-16(18,19)12-6-5-9(7-20-12)15(24)25-8-13-21-11-4-2-1-3-10(11)14(23)22-13/h1-7H,8H2,(H,21,22,23)