3-nitro-4-(2-piperidin-4-ylethylamino)benzenecarbonitrile

Systemtic Name: 3-nitro-4-(2-piperidin-4-ylethylamino)benzenecarbonitrile Openeye Name: 3-nitro-4-[2-(4-piperidyl)ethylamino]benzonitrile CAS Name: 3-nitro-4-[2-(4-piperidinyl)ethylamino]benzonitrile IUPAC Name: 3-nitro-4-(2-piperidin-4-ylethylamino)benzonitrile Traditional Name: 3-nitro-4-[2-(4-piperidyl)ethylamino]benzonitrile Formula: C14H18N4O2 MolecularWeight: 274.31832

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1CCNC2=C(C=C(C=C2)C#N)[N+](=O)[O-]

Isomeric SMILES

C1CNCCC1CCNC2=C(C=C(C=C2)C#N)[N+](=O)[O-]

InChI

InChI=1S/C14H18N4O2/c15-10-12-1-2-13(14(9-12)18(19)20)17-8-5-11-3-6-16-7-4-11/h1-2,9,11,16-17H,3-8H2