pyridin-3-ylmethanamine; 2,4,6-trinitrophenol

Systemtic Name: pyridin-3-ylmethanamine; 2,4,6-trinitrophenol Openeye Name: picric acid; 3-pyridylmethanamine CAS Name: 3-pyridinylmethanamine; 2,4,6-trinitrophenol IUPAC Name: pyridin-3-ylmethanamine; 2,4,6-trinitrophenol Traditional Name: picric acid; 3-pyridylmethylamine Formula: C12H11N5O7 MolecularWeight: 337.24504

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)CN.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CN=C1)CN.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C6H3N3O7.C6H8N2/c10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16;7-4-6-2-1-3-8-5-6/h1-2,10H;1-3,5H,4,7H2