2-oxidanyl-2-piperidin-4-yl-propanenitrile; 2,4,6-trinitrophenol

Systemtic Name: 2-oxidanyl-2-piperidin-4-yl-propanenitrile; 2,4,6-trinitrophenol Openeye Name: 2-hydroxy-2-(4-piperidyl)propanenitrile; picric acid CAS Name: 2-hydroxy-2-(4-piperidinyl)propanenitrile; 2,4,6-trinitrophenol IUPAC Name: 2-hydroxy-2-piperidin-4-ylpropanenitrile; 2,4,6-trinitrophenol Traditional Name: 2-hydroxy-2-(4-piperidyl)propionitrile; picric acid Formula: C14H17N5O8 MolecularWeight: 383.31348

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)(C1CCNCC1)O.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC(C#N)(C1CCNCC1)O.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C8H14N2O.C6H3N3O7/c1-8(11,6-9)7-2-4-10-5-3-7;10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16/h7,10-11H,2-5H2,1H3;1-2,10H