N-[2-[[2-nitro-4-(trifluoromethyl)phenyl]amino]ethyl]-2-oxidanylidene-1H-quinoline-3-carboxamide

Systemtic Name: N-[2-[[2-nitro-4-(trifluoromethyl)phenyl]amino]ethyl]-2-oxidanylidene-1H-quinoline-3-carboxamide Openeye Name: N-[2-[2-nitro-4-(trifluoromethyl)anilino]ethyl]-2-oxo-1H-quinoline-3-carboxamide CAS Name: N-[2-[2-nitro-4-(trifluoromethyl)anilino]ethyl]-2-oxo-1H-quinoline-3-carboxamide IUPAC Name: N-[2-[2-nitro-4-(trifluoromethyl)anilino]ethyl]-2-oxo-1H-quinoline-3-carboxamide Traditional Name: 2-keto-N-[2-[2-nitro-4-(trifluoromethyl)anilino]ethyl]-1H-quinoline-3-carboxamide Formula: C19H15F3N4O4 MolecularWeight: 420.34201

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(C(=O)N2)C(=O)NCCNC3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C=C(C(=O)N2)C(=O)NCCNC3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C19H15F3N4O4/c20-19(21,22)12-5-6-15(16(10-12)26(29)30)23-7-8-24-17(27)13-9-11-3-1-2-4-14(11)25-18(13)28/h1-6,9-10,23H,7-8H2,(H,24,27)(H,25,28)