2-[4-(2-nitrophenyl)piperazin-1-yl]ethanenitrile

Systemtic Name: 2-[4-(2-nitrophenyl)piperazin-1-yl]ethanenitrile Openeye Name: 2-[4-(2-nitrophenyl)piperazin-1-yl]acetonitrile CAS Name: 2-[4-(2-nitrophenyl)-1-piperazinyl]acetonitrile IUPAC Name: 2-[4-(2-nitrophenyl)piperazin-1-yl]acetonitrile Traditional Name: 2-[4-(2-nitrophenyl)piperazino]acetonitrile Formula: C12H14N4O2 MolecularWeight: 246.26516

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC#N)C2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1CC#N)C2=CC=CC=C2[N+](=O)[O-]

InChI

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