1-(3,5-dinitro-4-piperidin-1-yl-phenyl)ethanone

Systemtic Name: 1-(3,5-dinitro-4-piperidin-1-yl-phenyl)ethanone Openeye Name: 1-[3,5-dinitro-4-(1-piperidyl)phenyl]ethanone CAS Name: 1-[3,5-dinitro-4-(1-piperidinyl)phenyl]ethanone IUPAC Name: 1-(3,5-dinitro-4-piperidin-1-ylphenyl)ethanone Traditional Name: 1-(3,5-dinitro-4-piperidino-phenyl)ethanone Formula: C13H15N3O5 MolecularWeight: 293.2753

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C(=C1)[N+](=O)[O-])N2CCCCC2)[N+](=O)[O-]

Isomeric SMILES

CC(=O)C1=CC(=C(C(=C1)[N+](=O)[O-])N2CCCCC2)[N+](=O)[O-]

InChI

InChI=1S/C13H15N3O5/c1-9(17)10-7-11(15(18)19)13(12(8-10)16(20)21)14-5-3-2-4-6-14/h7-8H,2-6H2,1H3