3-methyl-2-(nitromethyl)pyridine; 2,4,6-trinitrophenol

Systemtic Name: 3-methyl-2-(nitromethyl)pyridine; 2,4,6-trinitrophenol Openeye Name: 3-methyl-2-(nitromethyl)pyridine; picric acid CAS Name: 3-methyl-2-(nitromethyl)pyridine; 2,4,6-trinitrophenol IUPAC Name: 3-methyl-2-(nitromethyl)pyridine; 2,4,6-trinitrophenol Traditional Name: 3-methyl-2-(nitromethyl)pyridine; picric acid Formula: C13H11N5O9 MolecularWeight: 381.25454

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CC=C1)C[N+](=O)[O-].C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=C(N=CC=C1)C[N+](=O)[O-].C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C7H8N2O2.C6H3N3O7/c1-6-3-2-4-8-7(6)5-9(10)11;10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16/h2-4H,5H2,1H3;1-2,10H