N1-phenyl-N2-(2,4,6-trinitrophenyl)benzene-1,2-diamine

Systemtic Name: N1-phenyl-N2-(2,4,6-trinitrophenyl)benzene-1,2-diamine Openeye Name: N1-phenyl-N2-(2,4,6-trinitrophenyl)benzene-1,2-diamine CAS Name: N1-phenyl-N2-(2,4,6-trinitrophenyl)benzene-1,2-diamine IUPAC Name: 1-N-phenyl-2-N-(2,4,6-trinitrophenyl)benzene-1,2-diamine Traditional Name: (2-anilinophenyl)-picryl-amine Formula: C18H13N5O6 MolecularWeight: 395.32572

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=CC=CC=C2NC3=C(C=C(C=C3[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)NC2=CC=CC=C2NC3=C(C=C(C=C3[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C18H13N5O6/c24-21(25)13-10-16(22(26)27)18(17(11-13)23(28)29)20-15-9-5-4-8-14(15)19-12-6-2-1-3-7-12/h1-11,19-20H