1-methyl-4-(phenylmethyl)piperidine; 2,4,6-trinitrophenol

Systemtic Name: 1-methyl-4-(phenylmethyl)piperidine; 2,4,6-trinitrophenol Openeye Name: 4-benzyl-1-methyl-piperidine; picric acid CAS Name: 1-methyl-4-(phenylmethyl)piperidine; 2,4,6-trinitrophenol IUPAC Name: 4-benzyl-1-methylpiperidine; 2,4,6-trinitrophenol Traditional Name: 4-benzyl-1-methyl-piperidine; picric acid Formula: C19H22N4O7 MolecularWeight: 418.40058

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(CC1)CC2=CC=CC=C2.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CN1CCC(CC1)CC2=CC=CC=C2.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C13H19N.C6H3N3O7/c1-14-9-7-13(8-10-14)11-12-5-3-2-4-6-12;10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16/h2-6,13H,7-11H2,1H3;1-2,10H