1-(4-nitrophenyl)carbonylpiperidine-4-carbonitrile

Systemtic Name: 1-(4-nitrophenyl)carbonylpiperidine-4-carbonitrile Openeye Name: 1-(4-nitrobenzoyl)piperidine-4-carbonitrile CAS Name: 1-[(4-nitrophenyl)-oxomethyl]-4-piperidinecarbonitrile IUPAC Name: 1-(4-nitrobenzoyl)piperidine-4-carbonitrile Traditional Name: 1-(4-nitrobenzoyl)isonipecotonitrile Formula: C13H13N3O3 MolecularWeight: 259.26062

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C#N)C(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCC1C#N)C(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H13N3O3/c14-9-10-5-7-15(8-6-10)13(17)11-1-3-12(4-2-11)16(18)19/h1-4,10H,5-8H2