methyl 5-(2-methoxy-2-oxidanylidene-ethyl)-1-methyl-pyrrolidine-2-carboxylate; 2,4,6-trinitrophenol

Systemtic Name: methyl 5-(2-methoxy-2-oxidanylidene-ethyl)-1-methyl-pyrrolidine-2-carboxylate; 2,4,6-trinitrophenol Openeye Name: methyl 5-(2-methoxy-2-oxo-ethyl)-1-methyl-pyrrolidine-2-carboxylate; picric acid CAS Name: 5-(2-methoxy-2-oxoethyl)-1-methyl-2-pyrrolidinecarboxylic acid methyl ester; 2,4,6-trinitrophenol IUPAC Name: methyl 5-(2-methoxy-2-oxoethyl)-1-methylpyrrolidine-2-carboxylate; 2,4,6-trinitrophenol Traditional Name: 5-(2-keto-2-methoxy-ethyl)-1-methyl-pyrrolidine-2-carboxylic acid methyl ester; picric acid Formula: C16H20N4O11 MolecularWeight: 444.3502

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(CCC1C(=O)OC)CC(=O)OC.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CN1C(CCC1C(=O)OC)CC(=O)OC.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C10H17NO4.C6H3N3O7/c1-11-7(6-9(12)14-2)4-5-8(11)10(13)15-3;10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16/h7-8H,4-6H2,1-3H3;1-2,10H