1-[4-(5-azanyl-2-chloranyl-4-nitro-phenyl)piperazin-1-yl]ethanone

Systemtic Name: 1-[4-(5-azanyl-2-chloranyl-4-nitro-phenyl)piperazin-1-yl]ethanone Openeye Name: 1-[4-(5-amino-2-chloro-4-nitro-phenyl)piperazin-1-yl]ethanone CAS Name: 1-[4-(5-amino-2-chloro-4-nitrophenyl)-1-piperazinyl]ethanone IUPAC Name: 1-[4-(5-amino-2-chloro-4-nitrophenyl)piperazin-1-yl]ethanone Traditional Name: 1-[4-(5-amino-2-chloro-4-nitro-phenyl)piperazino]ethanone Formula: C12H15ClN4O3 MolecularWeight: 298.7255

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C2=CC(=C(C=C2Cl)[N+](=O)[O-])N

Isomeric SMILES

CC(=O)N1CCN(CC1)C2=CC(=C(C=C2Cl)[N+](=O)[O-])N

InChI

InChI=1S/C12H15ClN4O3/c1-8(18)15-2-4-16(5-3-15)11-7-10(14)12(17(19)20)6-9(11)13/h6-7H,2-5,14H2,1H3