1-(3-phenylprop-2-ynyl)pyrrolidine; 2,4,6-trinitrophenol

Systemtic Name: 1-(3-phenylprop-2-ynyl)pyrrolidine; 2,4,6-trinitrophenol Openeye Name: 1-(3-phenylprop-2-ynyl)pyrrolidine; picric acid CAS Name: 1-(3-phenylprop-2-ynyl)pyrrolidine; 2,4,6-trinitrophenol IUPAC Name: 1-(3-phenylprop-2-ynyl)pyrrolidine; 2,4,6-trinitrophenol Traditional Name: 1-(3-phenylprop-2-ynyl)pyrrolidine; picric acid Formula: C19H18N4O7 MolecularWeight: 414.36882

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC#CC2=CC=CC=C2.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)CC#CC2=CC=CC=C2.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C13H15N.C6H3N3O7/c1-2-7-13(8-3-1)9-6-12-14-10-4-5-11-14;10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16/h1-3,7-8H,4-5,10-12H2;1-2,10H