2-propan-2-ylquinoline; 2,4,6-trinitrophenol

Systemtic Name: 2-propan-2-ylquinoline; 2,4,6-trinitrophenol Openeye Name: 2-isopropylquinoline; picric acid CAS Name: 2-propan-2-ylquinoline; 2,4,6-trinitrophenol IUPAC Name: 2-propan-2-ylquinoline; 2,4,6-trinitrophenol Traditional Name: 2-isopropylquinoline; picric acid Formula: C18H16N4O7 MolecularWeight: 400.34224

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC2=CC=CC=C2C=C1.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=NC2=CC=CC=C2C=C1.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C12H13N.C6H3N3O7/c1-9(2)11-8-7-10-5-3-4-6-12(10)13-11;10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16/h3-9H,1-2H3;1-2,10H