2-[[2,4-dinitro-6-(trifluoromethyl)phenyl]amino]quinoline-3-carbonitrile

Systemtic Name: 2-[[2,4-dinitro-6-(trifluoromethyl)phenyl]amino]quinoline-3-carbonitrile Openeye Name: 2-[2,4-dinitro-6-(trifluoromethyl)anilino]quinoline-3-carbonitrile CAS Name: 2-[2,4-dinitro-6-(trifluoromethyl)anilino]-3-quinolinecarbonitrile IUPAC Name: 2-[2,4-dinitro-6-(trifluoromethyl)anilino]quinoline-3-carbonitrile Traditional Name: 2-[2,4-dinitro-6-(trifluoromethyl)anilino]quinoline-3-carbonitrile Formula: C17H8F3N5O4 MolecularWeight: 403.27173

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(C(=N2)NC3=C(C=C(C=C3C(F)(F)F)[N+](=O)[O-])[N+](=O)[O-])C#N

Isomeric SMILES

C1=CC=C2C(=C1)C=C(C(=N2)NC3=C(C=C(C=C3C(F)(F)F)[N+](=O)[O-])[N+](=O)[O-])C#N

InChI

InChI=1S/C17H8F3N5O4/c18-17(19,20)12-6-11(24(26)27)7-14(25(28)29)15(12)23-16-10(8-21)5-9-3-1-2-4-13(9)22-16/h1-7H,(H,22,23)