5-nitro-2-piperidin-1-yl-benzenecarbonitrile

Systemtic Name: 5-nitro-2-piperidin-1-yl-benzenecarbonitrile Openeye Name: 5-nitro-2-(1-piperidyl)benzonitrile CAS Name: 5-nitro-2-(1-piperidinyl)benzonitrile IUPAC Name: 5-nitro-2-piperidin-1-ylbenzonitrile Traditional Name: 5-nitro-2-piperidino-benzonitrile Formula: C12H13N3O2 MolecularWeight: 231.25052

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=C(C=C2)[N+](=O)[O-])C#N

Isomeric SMILES

C1CCN(CC1)C2=C(C=C(C=C2)[N+](=O)[O-])C#N

InChI

InChI=1S/C12H13N3O2/c13-9-10-8-11(15(16)17)4-5-12(10)14-6-2-1-3-7-14/h4-5,8H,1-3,6-7H2