(4-ethylphenyl)-[4-(6-nitropyridin-3-yl)piperazin-1-yl]methanone

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=CN=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=CN=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H20N4O3/c1-2-14-3-5-15(6-4-14)18(23)21-11-9-20(10-12-21)16-7-8-17(19-13-16)22(24)25/h3-8,13H,2,9-12H2,1H3