1-[4-(3-chlorophenyl)piperazin-1-yl]-2-(6-methyl-2-nitro-pyridin-3-yl)oxy-ethanone

Systemtic Name: 1-[4-(3-chlorophenyl)piperazin-1-yl]-2-(6-methyl-2-nitro-pyridin-3-yl)oxy-ethanone Openeye Name: 1-[4-(3-chlorophenyl)piperazin-1-yl]-2-[(6-methyl-2-nitro-3-pyridyl)oxy]ethanone CAS Name: 1-[4-(3-chlorophenyl)-1-piperazinyl]-2-[(6-methyl-2-nitro-3-pyridinyl)oxy]ethanone IUPAC Name: 1-[4-(3-chlorophenyl)piperazin-1-yl]-2-(6-methyl-2-nitropyridin-3-yl)oxyethanone Traditional Name: 1-[4-(3-chlorophenyl)piperazino]-2-[(6-methyl-2-nitro-3-pyridyl)oxy]ethanone Formula: C18H19ClN4O4 MolecularWeight: 390.82086

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C=C1)OCC(=O)N2CCN(CC2)C3=CC(=CC=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=NC(=C(C=C1)OCC(=O)N2CCN(CC2)C3=CC(=CC=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C18H19ClN4O4/c1-13-5-6-16(18(20-13)23(25)26)27-12-17(24)22-9-7-21(8-10-22)15-4-2-3-14(19)11-15/h2-6,11H,7-10,12H2,1H3