(3,5-dinitrophenyl)-[2-(hydroxymethyl)piperidin-1-yl]methanone

Systemtic Name: (3,5-dinitrophenyl)-[2-(hydroxymethyl)piperidin-1-yl]methanone Openeye Name: (3,5-dinitrophenyl)-[2-(hydroxymethyl)-1-piperidyl]methanone CAS Name: (3,5-dinitrophenyl)-[2-(hydroxymethyl)-1-piperidinyl]methanone IUPAC Name: (3,5-dinitrophenyl)-[2-(hydroxymethyl)piperidin-1-yl]methanone Traditional Name: (3,5-dinitrophenyl)-(2-methylolpiperidino)methanone Formula: C13H15N3O6 MolecularWeight: 309.2747

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)CO)C(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1CCN(C(C1)CO)C(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C13H15N3O6/c17-8-10-3-1-2-4-14(10)13(18)9-5-11(15(19)20)7-12(6-9)16(21)22/h5-7,10,17H,1-4,8H2