N-[(E)-(5-methylfuran-2-yl)methylideneamino]-2,6-dinitro-4-(trifluoromethyl)aniline

Systemtic Name: N-[(E)-(5-methylfuran-2-yl)methylideneamino]-2,6-dinitro-4-(trifluoromethyl)aniline Openeye Name: N-[(E)-(5-methyl-2-furyl)methyleneamino]-2,6-dinitro-4-(trifluoromethyl)aniline CAS Name: N-[(E)-(5-methyl-2-furanyl)methylideneamino]-2,6-dinitro-4-(trifluoromethyl)aniline IUPAC Name: N-[(E)-(5-methylfuran-2-yl)methylideneamino]-2,6-dinitro-4-(trifluoromethyl)aniline Traditional Name: [2,6-dinitro-4-(trifluoromethyl)phenyl]-[(E)-(5-methyl-2-furyl)methyleneamino]amine Formula: C13H9F3N4O5 MolecularWeight: 358.22957

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C=NNC2=C(C=C(C=C2[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(O1)/C=N/NC2=C(C=C(C=C2[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C13H9F3N4O5/c1-7-2-3-9(25-7)6-17-18-12-10(19(21)22)4-8(13(14,15)16)5-11(12)20(23)24/h2-6,18H,1H3/b17-6+