4-[[6-methyl-2-(trifluoromethyl)quinazolin-4-yl]amino]-2-oxidanyl-benzoate

Systemtic Name: 4-[[6-methyl-2-(trifluoromethyl)quinazolin-4-yl]amino]-2-oxidanyl-benzoate Openeye Name: 2-hydroxy-4-[[6-methyl-2-(trifluoromethyl)quinazolin-4-yl]amino]benzoate CAS Name: 2-hydroxy-4-[[6-methyl-2-(trifluoromethyl)-4-quinazolinyl]amino]benzoate IUPAC Name: 2-hydroxy-4-[[6-methyl-2-(trifluoromethyl)quinazolin-4-yl]amino]benzoate Traditional Name: 2-hydroxy-4-[[6-methyl-2-(trifluoromethyl)quinazolin-4-yl]amino]benzoate Formula: C17H11F3N3O3- MolecularWeight: 362.28275

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(N=C2NC3=CC(=C(C=C3)C(=O)[O-])O)C(F)(F)F

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(N=C2NC3=CC(=C(C=C3)C(=O)[O-])O)C(F)(F)F

InChI

InChI=1S/C17H12F3N3O3/c1-8-2-5-12-11(6-8)14(23-16(22-12)17(18,19)20)21-9-3-4-10(15(25)26)13(24)7-9/h2-7,24H,1H3,(H,25,26)(H,21,22,23)/p-1