2-[bis(2-hydroxyethyl)amino]ethanol; 2,4,6-trinitrophenol

Systemtic Name: 2-[bis(2-hydroxyethyl)amino]ethanol; 2,4,6-trinitrophenol Openeye Name: 2-[bis(2-hydroxyethyl)amino]ethanol; picric acid CAS Name: 2-[bis(2-hydroxyethyl)amino]ethanol; 2,4,6-trinitrophenol IUPAC Name: 2-[bis(2-hydroxyethyl)amino]ethanol; 2,4,6-trinitrophenol Traditional Name: 2-[bis(2-hydroxyethyl)amino]ethanol; picric acid Formula: C12H18N4O10 MolecularWeight: 378.29212

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C6H3N3O7.C6H15NO3/c10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16;8-4-1-7(2-5-9)3-6-10/h1-2,10H;8-10H,1-6H2