N,N-dimethyl-1-oxidanidyl-piperidin-1-ium-4-amine; 2,4,6-trinitrophenol

Systemtic Name: N,N-dimethyl-1-oxidanidyl-piperidin-1-ium-4-amine; 2,4,6-trinitrophenol Openeye Name: N,N-dimethyl-1-oxido-piperidin-1-ium-4-amine; picric acid CAS Name: N,N-dimethyl-1-oxido-4-piperidin-1-iumamine; 2,4,6-trinitrophenol IUPAC Name: N,N-dimethyl-1-oxidopiperidin-1-ium-4-amine; 2,4,6-trinitrophenol Traditional Name: dimethyl-(1-oxidopiperidin-1-ium-4-yl)amine; picric acid Formula: C13H19N5O8 MolecularWeight: 373.31866

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1CC[NH+](CC1)[O-].C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CN(C)C1CC[NH+](CC1)[O-].C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C7H16N2O.C6H3N3O7/c1-8(2)7-3-5-9(10)6-4-7;10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16/h7,9H,3-6H2,1-2H3;1-2,10H