1-(furan-2-ylmethyl)pyrrolidine; 2,4,6-trinitrophenol

Systemtic Name: 1-(furan-2-ylmethyl)pyrrolidine; 2,4,6-trinitrophenol Openeye Name: 1-(2-furylmethyl)pyrrolidine; picric acid CAS Name: 1-(2-furanylmethyl)pyrrolidine; 2,4,6-trinitrophenol IUPAC Name: 1-(furan-2-ylmethyl)pyrrolidine; 2,4,6-trinitrophenol Traditional Name: 1-(2-furfuryl)pyrrolidine; picric acid Formula: C15H16N4O8 MolecularWeight: 380.30954

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC2=CC=CO2.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)CC2=CC=CO2.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C9H13NO.C6H3N3O7/c1-2-6-10(5-1)8-9-4-3-7-11-9;10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16/h3-4,7H,1-2,5-6,8H2;1-2,10H