piperidin-2-one; 2,4,6-trinitrophenol

Systemtic Name: piperidin-2-one; 2,4,6-trinitrophenol Openeye Name: picric acid; piperidin-2-one CAS Name: 2-piperidinone; 2,4,6-trinitrophenol IUPAC Name: piperidin-2-one; 2,4,6-trinitrophenol Traditional Name: picric acid; 2-piperidone Formula: C11H12N4O8 MolecularWeight: 328.23498

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)C1.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1CCNC(=O)C1.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C6H3N3O7.C5H9NO/c10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16;7-5-3-1-2-4-6-5/h1-2,10H;1-4H2,(H,6,7)