1-tert-butylpiperazine; 2,4,6-trinitrophenol

Systemtic Name: 1-tert-butylpiperazine; 2,4,6-trinitrophenol Openeye Name: 1-tert-butylpiperazine; picric acid CAS Name: 1-tert-butylpiperazine; 2,4,6-trinitrophenol IUPAC Name: 1-tert-butylpiperazine; 2,4,6-trinitrophenol Traditional Name: 1-tert-butylpiperazine; picric acid Formula: C14H21N5O7 MolecularWeight: 371.34584

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1CCNCC1.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)N1CCNCC1.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C8H18N2.C6H3N3O7/c1-8(2,3)10-6-4-9-5-7-10;10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16/h9H,4-7H2,1-3H3;1-2,10H