1-(5-nitro-2-piperidin-1-yl-phenyl)ethanone

Systemtic Name: 1-(5-nitro-2-piperidin-1-yl-phenyl)ethanone Openeye Name: 1-[5-nitro-2-(1-piperidyl)phenyl]ethanone CAS Name: 1-[5-nitro-2-(1-piperidinyl)phenyl]ethanone IUPAC Name: 1-(5-nitro-2-piperidin-1-ylphenyl)ethanone Traditional Name: 1-(5-nitro-2-piperidino-phenyl)ethanone Formula: C13H16N2O3 MolecularWeight: 248.27774

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16N2O3/c1-10(16)12-9-11(15(17)18)5-6-13(12)14-7-3-2-4-8-14/h5-6,9H,2-4,7-8H2,1H3