3-[2-[4-(2-nitrophenyl)piperazin-1-yl]-2-oxidanylidene-ethoxy]benzenecarbonitrile

Systemtic Name: 3-[2-[4-(2-nitrophenyl)piperazin-1-yl]-2-oxidanylidene-ethoxy]benzenecarbonitrile Openeye Name: 3-[2-[4-(2-nitrophenyl)piperazin-1-yl]-2-oxo-ethoxy]benzonitrile CAS Name: 3-[2-[4-(2-nitrophenyl)-1-piperazinyl]-2-oxoethoxy]benzonitrile IUPAC Name: 3-[2-[4-(2-nitrophenyl)piperazin-1-yl]-2-oxoethoxy]benzonitrile Traditional Name: 3-[2-keto-2-[4-(2-nitrophenyl)piperazino]ethoxy]benzonitrile Formula: C19H18N4O4 MolecularWeight: 366.37062

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2[N+](=O)[O-])C(=O)COC3=CC=CC(=C3)C#N

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2[N+](=O)[O-])C(=O)COC3=CC=CC(=C3)C#N

InChI

InChI=1S/C19H18N4O4/c20-13-15-4-3-5-16(12-15)27-14-19(24)22-10-8-21(9-11-22)17-6-1-2-7-18(17)23(25)26/h1-7,12H,8-11,14H2