3-nitro-4-(piperidin-4-ylamino)benzenecarbonitrile

Systemtic Name: 3-nitro-4-(piperidin-4-ylamino)benzenecarbonitrile Openeye Name: 3-nitro-4-(4-piperidylamino)benzonitrile CAS Name: 3-nitro-4-(4-piperidinylamino)benzonitrile IUPAC Name: 3-nitro-4-(piperidin-4-ylamino)benzonitrile Traditional Name: 3-nitro-4-(4-piperidylamino)benzonitrile Formula: C12H14N4O2 MolecularWeight: 246.26516

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1NC2=C(C=C(C=C2)C#N)[N+](=O)[O-]

Isomeric SMILES

C1CNCCC1NC2=C(C=C(C=C2)C#N)[N+](=O)[O-]

InChI

InChI=1S/C12H14N4O2/c13-8-9-1-2-11(12(7-9)16(17)18)15-10-3-5-14-6-4-10/h1-2,7,10,14-15H,3-6H2