4-[6-azanyl-4-oxidanylidene-2-(trifluoromethyl)quinazolin-3-yl]benzoic acid

Systemtic Name: 4-[6-azanyl-4-oxidanylidene-2-(trifluoromethyl)quinazolin-3-yl]benzoic acid Openeye Name: 4-[6-amino-4-oxo-2-(trifluoromethyl)quinazolin-3-yl]benzoic acid CAS Name: 4-[6-amino-4-oxo-2-(trifluoromethyl)-3-quinazolinyl]benzoic acid IUPAC Name: 4-[6-amino-4-oxo-2-(trifluoromethyl)quinazolin-3-yl]benzoic acid Traditional Name: 4-[6-amino-4-keto-2-(trifluoromethyl)quinazolin-3-yl]benzoic acid Formula: C16H10F3N3O3 MolecularWeight: 349.26411

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)O)N2C(=O)C3=C(C=CC(=C3)N)N=C2C(F)(F)F

Isomeric SMILES

C1=CC(=CC=C1C(=O)O)N2C(=O)C3=C(C=CC(=C3)N)N=C2C(F)(F)F

InChI

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