4,6-dinitro-N1,N3-bis(4-nitrophenyl)benzene-1,3-diamine

Systemtic Name: 4,6-dinitro-N1,N3-bis(4-nitrophenyl)benzene-1,3-diamine Openeye Name: 4,6-dinitro-N1,N3-bis(4-nitrophenyl)benzene-1,3-diamine CAS Name: 4,6-dinitro-N1,N3-bis(4-nitrophenyl)benzene-1,3-diamine IUPAC Name: 4,6-dinitro-1-N,3-N-bis(4-nitrophenyl)benzene-1,3-diamine Traditional Name: [2,4-dinitro-5-(4-nitroanilino)phenyl]-(4-nitrophenyl)amine Formula: C18H12N6O8 MolecularWeight: 440.32328

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC2=CC(=C(C=C2[N+](=O)[O-])[N+](=O)[O-])NC3=CC=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1NC2=CC(=C(C=C2[N+](=O)[O-])[N+](=O)[O-])NC3=CC=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C18H12N6O8/c25-21(26)13-5-1-11(2-6-13)19-15-9-16(18(24(31)32)10-17(15)23(29)30)20-12-3-7-14(8-4-12)22(27)28/h1-10,19-20H