N-[(E)-1-(1-benzofuran-2-yl)ethylideneamino]-2,6-dinitro-4-(trifluoromethyl)aniline

Systemtic Name: N-[(E)-1-(1-benzofuran-2-yl)ethylideneamino]-2,6-dinitro-4-(trifluoromethyl)aniline Openeye Name: N-[(E)-1-(benzofuran-2-yl)ethylideneamino]-2,6-dinitro-4-(trifluoromethyl)aniline CAS Name: N-[(E)-1-(2-benzofuranyl)ethylideneamino]-2,6-dinitro-4-(trifluoromethyl)aniline IUPAC Name: N-[(E)-1-(1-benzofuran-2-yl)ethylideneamino]-2,6-dinitro-4-(trifluoromethyl)aniline Traditional Name: [(E)-1-(benzofuran-2-yl)ethylideneamino]-[2,6-dinitro-4-(trifluoromethyl)phenyl]amine Formula: C17H11F3N4O5 MolecularWeight: 408.28825

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC1=C(C=C(C=C1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-])C2=CC3=CC=CC=C3O2

Isomeric SMILES

C/C(=N\NC1=C(C=C(C=C1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-])/C2=CC3=CC=CC=C3O2

InChI

InChI=1S/C17H11F3N4O5/c1-9(15-6-10-4-2-3-5-14(10)29-15)21-22-16-12(23(25)26)7-11(17(18,19)20)8-13(16)24(27)28/h2-8,22H,1H3/b21-9+