2,6-bis(furan-2-yl)-3-(phenylmethyl)piperidin-4-one; 2,4,6-trinitrophenol

Systemtic Name: 2,6-bis(furan-2-yl)-3-(phenylmethyl)piperidin-4-one; 2,4,6-trinitrophenol Openeye Name: 3-benzyl-2,6-bis(2-furyl)piperidin-4-one; picric acid CAS Name: 2,6-bis(2-furanyl)-3-(phenylmethyl)-4-piperidinone; 2,4,6-trinitrophenol IUPAC Name: 3-benzyl-2,6-bis(furan-2-yl)piperidin-4-one; 2,4,6-trinitrophenol Traditional Name: 3-benzyl-2,6-bis(2-furyl)-4-piperidone; picric acid Formula: C26H22N4O10 MolecularWeight: 550.47368

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Descriptors Computed from Structure

Canonical SMILES:

C1C(NC(C(C1=O)CC2=CC=CC=C2)C3=CC=CO3)C4=CC=CO4.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1C(NC(C(C1=O)CC2=CC=CC=C2)C3=CC=CO3)C4=CC=CO4.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C20H19NO3.C6H3N3O7/c22-17-13-16(18-8-4-10-23-18)21-20(19-9-5-11-24-19)15(17)12-14-6-2-1-3-7-14;10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16/h1-11,15-16,20-21H,12-13H2;1-2,10H