1-[4-(6-nitropyridin-3-yl)piperazin-1-yl]-3-phenyl-propan-1-one

Systemtic Name: 1-[4-(6-nitropyridin-3-yl)piperazin-1-yl]-3-phenyl-propan-1-one Openeye Name: 1-[4-(6-nitro-3-pyridyl)piperazin-1-yl]-3-phenyl-propan-1-one CAS Name: 1-[4-(6-nitro-3-pyridinyl)-1-piperazinyl]-3-phenyl-1-propanone IUPAC Name: 1-[4-(6-nitropyridin-3-yl)piperazin-1-yl]-3-phenylpropan-1-one Traditional Name: 1-[4-(6-nitro-3-pyridyl)piperazino]-3-phenyl-propan-1-one Formula: C18H20N4O3 MolecularWeight: 340.3764

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CN=C(C=C2)[N+](=O)[O-])C(=O)CCC3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1C2=CN=C(C=C2)[N+](=O)[O-])C(=O)CCC3=CC=CC=C3

InChI

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