2-methoxy-N-(2-piperidin-4-ylethyl)pyridine-3-carboxamide; 2,4,6-trinitrophenol

Systemtic Name: 2-methoxy-N-(2-piperidin-4-ylethyl)pyridine-3-carboxamide; 2,4,6-trinitrophenol Openeye Name: 2-methoxy-N-[2-(4-piperidyl)ethyl]pyridine-3-carboxamide; picric acid CAS Name: 2-methoxy-N-[2-(4-piperidinyl)ethyl]-3-pyridinecarboxamide; 2,4,6-trinitrophenol IUPAC Name: 2-methoxy-N-(2-piperidin-4-ylethyl)pyridine-3-carboxamide; 2,4,6-trinitrophenol Traditional Name: 2-methoxy-N-[2-(4-piperidyl)ethyl]nicotinamide; picric acid Formula: C20H24N6O9 MolecularWeight: 492.43936

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC=N1)C(=O)NCCC2CCNCC2.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=CC=N1)C(=O)NCCC2CCNCC2.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C14H21N3O2.C6H3N3O7/c1-19-14-12(3-2-7-17-14)13(18)16-10-6-11-4-8-15-9-5-11;10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16/h2-3,7,11,15H,4-6,8-10H2,1H3,(H,16,18);1-2,10H