(2R)-2-[[7-methoxy-2-(trifluoromethyl)quinazolin-4-yl]amino]pentanedioic acid

Systemtic Name: (2R)-2-[[7-methoxy-2-(trifluoromethyl)quinazolin-4-yl]amino]pentanedioic acid Openeye Name: (2R)-2-[[7-methoxy-2-(trifluoromethyl)quinazolin-4-yl]amino]pentanedioic acid CAS Name: (2R)-2-[[7-methoxy-2-(trifluoromethyl)-4-quinazolinyl]amino]pentanedioic acid IUPAC Name: (2R)-2-[[7-methoxy-2-(trifluoromethyl)quinazolin-4-yl]amino]pentanedioic acid Traditional Name: (2R)-2-[[7-methoxy-2-(trifluoromethyl)quinazolin-4-yl]amino]glutaric acid Formula: C15H14F3N3O5 MolecularWeight: 373.28397

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=NC(=N2)C(F)(F)F)NC(CCC(=O)O)C(=O)O

Isomeric SMILES

COC1=CC2=C(C=C1)C(=NC(=N2)C(F)(F)F)N[C@H](CCC(=O)O)C(=O)O

InChI

InChI=1S/C15H14F3N3O5/c1-26-7-2-3-8-10(6-7)20-14(15(16,17)18)21-12(8)19-9(13(24)25)4-5-11(22)23/h2-3,6,9H,4-5H2,1H3,(H,22,23)(H,24,25)(H,19,20,21)/t9-/m1/s1