3,5-diphenyl-2-propan-2-yl-pyridine; 2,4,6-trinitrophenol

Systemtic Name: 3,5-diphenyl-2-propan-2-yl-pyridine; 2,4,6-trinitrophenol Openeye Name: 2-isopropyl-3,5-diphenyl-pyridine; picric acid CAS Name: 3,5-diphenyl-2-propan-2-ylpyridine; 2,4,6-trinitrophenol IUPAC Name: 3,5-diphenyl-2-propan-2-ylpyridine; 2,4,6-trinitrophenol Traditional Name: 2-isopropyl-3,5-diphenyl-pyridine; picric acid Formula: C26H22N4O7 MolecularWeight: 502.47548

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C=C(C=N1)C2=CC=CC=C2)C3=CC=CC=C3.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=C(C=C(C=N1)C2=CC=CC=C2)C3=CC=CC=C3.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C20H19N.C6H3N3O7/c1-15(2)20-19(17-11-7-4-8-12-17)13-18(14-21-20)16-9-5-3-6-10-16;10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16/h3-15H,1-2H3;1-2,10H