4-[[7-methoxy-2-(trifluoromethyl)quinazolin-4-yl]amino]butanoate

Systemtic Name: 4-[[7-methoxy-2-(trifluoromethyl)quinazolin-4-yl]amino]butanoate Openeye Name: 4-[[7-methoxy-2-(trifluoromethyl)quinazolin-4-yl]amino]butanoate CAS Name: 4-[[7-methoxy-2-(trifluoromethyl)-4-quinazolinyl]amino]butanoate IUPAC Name: 4-[[7-methoxy-2-(trifluoromethyl)quinazolin-4-yl]amino]butanoate Traditional Name: 4-[[7-methoxy-2-(trifluoromethyl)quinazolin-4-yl]amino]butyrate Formula: C14H13F3N3O3- MolecularWeight: 328.26653

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=NC(=N2)C(F)(F)F)NCCCC(=O)[O-]

Isomeric SMILES

COC1=CC2=C(C=C1)C(=NC(=N2)C(F)(F)F)NCCCC(=O)[O-]

InChI

InChI=1S/C14H14F3N3O3/c1-23-8-4-5-9-10(7-8)19-13(14(15,16)17)20-12(9)18-6-2-3-11(21)22/h4-5,7H,2-3,6H2,1H3,(H,21,22)(H,18,19,20)/p-1