1-methyl-4-phenyl-piperidin-4-ol; 2,4,6-trinitrophenol

Systemtic Name: 1-methyl-4-phenyl-piperidin-4-ol; 2,4,6-trinitrophenol Openeye Name: 1-methyl-4-phenyl-piperidin-4-ol; picric acid CAS Name: 1-methyl-4-phenyl-4-piperidinol; 2,4,6-trinitrophenol IUPAC Name: 1-methyl-4-phenylpiperidin-4-ol; 2,4,6-trinitrophenol Traditional Name: 1-methyl-4-phenyl-piperidin-4-ol; picric acid Formula: C18H20N4O8 MolecularWeight: 420.3734

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H17NO.C6H3N3O7/c1-13-9-7-12(14,8-10-13)11-5-3-2-4-6-11;10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16/h2-6,14H,7-10H2,1H3;1-2,10H