dimethyl-oxidanyl-(phenylmethyl)azanium; 2,4,6-trinitrophenol

Systemtic Name: dimethyl-oxidanyl-(phenylmethyl)azanium; 2,4,6-trinitrophenol Openeye Name: benzyl-hydroxy-dimethyl-ammonium; picric acid CAS Name: hydroxy-dimethyl-(phenylmethyl)ammonium; 2,4,6-trinitrophenol IUPAC Name: benzyl-hydroxy-dimethylazanium; 2,4,6-trinitrophenol Traditional Name: benzyl-hydroxy-dimethyl-ammonium; picric acid Formula: C15H17N4O8+ MolecularWeight: 381.31748

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H14NO.C6H3N3O7/c1-10(2,11)8-9-6-4-3-5-7-9;10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16/h3-7,11H,8H2,1-2H3;1-2,10H/q+1;