methyl 4-oxidanylidene-2-[[3-(trifluoromethyl)phenyl]carbonyloxymethyl]-1H-quinazoline-7-carboxylate

Systemtic Name: methyl 4-oxidanylidene-2-[[3-(trifluoromethyl)phenyl]carbonyloxymethyl]-1H-quinazoline-7-carboxylate Openeye Name: methyl 4-oxo-2-[[3-(trifluoromethyl)benzoyl]oxymethyl]-1H-quinazoline-7-carboxylate CAS Name: 4-oxo-2-[[oxo-[3-(trifluoromethyl)phenyl]methoxy]methyl]-1H-quinazoline-7-carboxylic acid methyl ester IUPAC Name: methyl 4-oxo-2-[[3-(trifluoromethyl)benzoyl]oxymethyl]-1H-quinazoline-7-carboxylate Traditional Name: 4-keto-2-[[3-(trifluoromethyl)benzoyl]oxymethyl]-1H-quinazoline-7-carboxylic acid methyl ester Formula: C19H13F3N2O5 MolecularWeight: 406.31213

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)C(=O)N=C(N2)COC(=O)C3=CC(=CC=C3)C(F)(F)F

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)C(=O)N=C(N2)COC(=O)C3=CC(=CC=C3)C(F)(F)F

InChI

InChI=1S/C19H13F3N2O5/c1-28-17(26)11-5-6-13-14(8-11)23-15(24-16(13)25)9-29-18(27)10-3-2-4-12(7-10)19(20,21)22/h2-8H,9H2,1H3,(H,23,24,25)