1-(3-nitro-4-piperidin-1-yl-phenyl)ethanone

Systemtic Name: 1-(3-nitro-4-piperidin-1-yl-phenyl)ethanone Openeye Name: 1-[3-nitro-4-(1-piperidyl)phenyl]ethanone CAS Name: 1-[3-nitro-4-(1-piperidinyl)phenyl]ethanone IUPAC Name: 1-(3-nitro-4-piperidin-1-ylphenyl)ethanone Traditional Name: 1-(3-nitro-4-piperidino-phenyl)ethanone Formula: C13H16N2O3 MolecularWeight: 248.27774

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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