N-(2-cyanoethyl)-2-[4-(4-nitrophenyl)piperazin-1-yl]ethanamide

Systemtic Name: N-(2-cyanoethyl)-2-[4-(4-nitrophenyl)piperazin-1-yl]ethanamide Openeye Name: N-(2-cyanoethyl)-2-[4-(4-nitrophenyl)piperazin-1-yl]acetamide CAS Name: N-(2-cyanoethyl)-2-[4-(4-nitrophenyl)-1-piperazinyl]acetamide IUPAC Name: N-(2-cyanoethyl)-2-[4-(4-nitrophenyl)piperazin-1-yl]acetamide Traditional Name: N-(2-cyanoethyl)-2-[4-(4-nitrophenyl)piperazino]acetamide Formula: C15H19N5O3 MolecularWeight: 317.34306

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H19N5O3/c16-6-1-7-17-15(21)12-18-8-10-19(11-9-18)13-2-4-14(5-3-13)20(22)23/h2-5H,1,7-12H2,(H,17,21)