4-[(3-oxidanidyl-3-oxidanylidene-propyl)amino]-8-(trifluoromethyl)quinoline-3-carboxylate

Systemtic Name: 4-[(3-oxidanidyl-3-oxidanylidene-propyl)amino]-8-(trifluoromethyl)quinoline-3-carboxylate Openeye Name: 4-[(3-oxido-3-oxo-propyl)amino]-8-(trifluoromethyl)quinoline-3-carboxylate CAS Name: 4-[(3-oxido-3-oxopropyl)amino]-8-(trifluoromethyl)-3-quinolinecarboxylate IUPAC Name: 4-[(3-oxido-3-oxopropyl)amino]-8-(trifluoromethyl)quinoline-3-carboxylate Traditional Name: 4-[(3-keto-3-oxido-propyl)amino]-8-(trifluoromethyl)quinoline-3-carboxylate Formula: C14H9F3N2O4-2 MolecularWeight: 326.22747

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=CN=C2C(=C1)C(F)(F)F)C(=O)[O-])NCCC(=O)[O-]

Isomeric SMILES

C1=CC2=C(C(=CN=C2C(=C1)C(F)(F)F)C(=O)[O-])NCCC(=O)[O-]

InChI

InChI=1S/C14H11F3N2O4/c15-14(16,17)9-3-1-2-7-11(18-5-4-10(20)21)8(13(22)23)6-19-12(7)9/h1-3,6H,4-5H2,(H,18,19)(H,20,21)(H,22,23)/p-2