2,4-dinitro-N-[(E)-5-(2-nitrophenoxy)pentan-2-ylideneamino]aniline

Systemtic Name: 2,4-dinitro-N-[(E)-5-(2-nitrophenoxy)pentan-2-ylideneamino]aniline Openeye Name: N-[(E)-[1-methyl-4-(2-nitrophenoxy)butylidene]amino]-2,4-dinitro-aniline CAS Name: 2,4-dinitro-N-[(E)-5-(2-nitrophenoxy)pentan-2-ylideneamino]aniline IUPAC Name: 2,4-dinitro-N-[(E)-5-(2-nitrophenoxy)pentan-2-ylideneamino]aniline Traditional Name: (2,4-dinitrophenyl)-[(E)-[1-methyl-4-(2-nitrophenoxy)butylidene]amino]amine Formula: C17H17N5O7 MolecularWeight: 403.34618

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-])CCCOC2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

C/C(=N\NC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-])/CCCOC2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C17H17N5O7/c1-12(5-4-10-29-17-7-3-2-6-15(17)21(25)26)18-19-14-9-8-13(20(23)24)11-16(14)22(27)28/h2-3,6-9,11,19H,4-5,10H2,1H3/b18-12+