2-(4-nitrophenyl)-1-[4-(pyridin-4-ylmethyl)piperazin-1-yl]ethanone

Systemtic Name: 2-(4-nitrophenyl)-1-[4-(pyridin-4-ylmethyl)piperazin-1-yl]ethanone Openeye Name: 2-(4-nitrophenyl)-1-[4-(4-pyridylmethyl)piperazin-1-yl]ethanone CAS Name: 2-(4-nitrophenyl)-1-[4-(pyridin-4-ylmethyl)-1-piperazinyl]ethanone IUPAC Name: 2-(4-nitrophenyl)-1-[4-(pyridin-4-ylmethyl)piperazin-1-yl]ethanone Traditional Name: 2-(4-nitrophenyl)-1-[4-(4-pyridylmethyl)piperazino]ethanone Formula: C18H20N4O3 MolecularWeight: 340.3764

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=NC=C2)C(=O)CC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1CC2=CC=NC=C2)C(=O)CC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H20N4O3/c23-18(13-15-1-3-17(4-2-15)22(24)25)21-11-9-20(10-12-21)14-16-5-7-19-8-6-16/h1-8H,9-14H2