2-[4-[[6,7-dimethoxy-2-(trifluoromethyl)quinazolin-4-yl]amino]phenyl]ethanoate

Systemtic Name: 2-[4-[[6,7-dimethoxy-2-(trifluoromethyl)quinazolin-4-yl]amino]phenyl]ethanoate Openeye Name: 2-[4-[[6,7-dimethoxy-2-(trifluoromethyl)quinazolin-4-yl]amino]phenyl]acetate CAS Name: 2-[4-[[6,7-dimethoxy-2-(trifluoromethyl)-4-quinazolinyl]amino]phenyl]acetate IUPAC Name: 2-[4-[[6,7-dimethoxy-2-(trifluoromethyl)quinazolin-4-yl]amino]phenyl]acetate Traditional Name: 2-[4-[[6,7-dimethoxy-2-(trifluoromethyl)quinazolin-4-yl]amino]phenyl]acetate Formula: C19H15F3N3O4- MolecularWeight: 406.33531

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC(=N2)C(F)(F)F)NC3=CC=C(C=C3)CC(=O)[O-])OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC(=N2)C(F)(F)F)NC3=CC=C(C=C3)CC(=O)[O-])OC

InChI

InChI=1S/C19H16F3N3O4/c1-28-14-8-12-13(9-15(14)29-2)24-18(19(20,21)22)25-17(12)23-11-5-3-10(4-6-11)7-16(26)27/h3-6,8-9H,7H2,1-2H3,(H,26,27)(H,23,24,25)/p-1