2,4,6-trinitro-N-(pyridin-2-ylmethyl)aniline

Systemtic Name: 2,4,6-trinitro-N-(pyridin-2-ylmethyl)aniline Openeye Name: 2,4,6-trinitro-N-(2-pyridylmethyl)aniline CAS Name: 2,4,6-trinitro-N-(2-pyridinylmethyl)aniline IUPAC Name: 2,4,6-trinitro-N-(pyridin-2-ylmethyl)aniline Traditional Name: picryl(2-pyridylmethyl)amine Formula: C12H9N5O6 MolecularWeight: 319.22976

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)CNC2=C(C=C(C=C2[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=NC(=C1)CNC2=C(C=C(C=C2[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C12H9N5O6/c18-15(19)9-5-10(16(20)21)12(11(6-9)17(22)23)14-7-8-3-1-2-4-13-8/h1-6,14H,7H2