methyl 2-[8-bromanyl-6-methyl-4-oxidanylidene-2-(trifluoromethyl)quinazolin-3-yl]ethanoate

Systemtic Name: methyl 2-[8-bromanyl-6-methyl-4-oxidanylidene-2-(trifluoromethyl)quinazolin-3-yl]ethanoate Openeye Name: methyl 2-[8-bromo-6-methyl-4-oxo-2-(trifluoromethyl)quinazolin-3-yl]acetate CAS Name: 2-[8-bromo-6-methyl-4-oxo-2-(trifluoromethyl)-3-quinazolinyl]acetic acid methyl ester IUPAC Name: methyl 2-[8-bromo-6-methyl-4-oxo-2-(trifluoromethyl)quinazolin-3-yl]acetate Traditional Name: 2-[8-bromo-4-keto-6-methyl-2-(trifluoromethyl)quinazolin-3-yl]acetic acid methyl ester Formula: C13H10BrF3N2O3 MolecularWeight: 379.12931

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C(=O)N(C(=N2)C(F)(F)F)CC(=O)OC)Br

Isomeric SMILES

CC1=CC(=C2C(=C1)C(=O)N(C(=N2)C(F)(F)F)CC(=O)OC)Br

InChI

InChI=1S/C13H10BrF3N2O3/c1-6-3-7-10(8(14)4-6)18-12(13(15,16)17)19(11(7)21)5-9(20)22-2/h3-4H,5H2,1-2H3