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

Systemtic Name: 2-(4-bromanylphenoxy)-1-[4-(2-chloranyl-4-nitro-phenyl)piperazin-1-yl]ethanone Openeye Name: 2-(4-bromophenoxy)-1-[4-(2-chloro-4-nitro-phenyl)piperazin-1-yl]ethanone CAS Name: 2-(4-bromophenoxy)-1-[4-(2-chloro-4-nitrophenyl)-1-piperazinyl]ethanone IUPAC Name: 2-(4-bromophenoxy)-1-[4-(2-chloro-4-nitrophenyl)piperazin-1-yl]ethanone Traditional Name: 2-(4-bromophenoxy)-1-[4-(2-chloro-4-nitro-phenyl)piperazino]ethanone Formula: C18H17BrClN3O4 MolecularWeight: 454.70228

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=C(C=C2)[N+](=O)[O-])Cl)C(=O)COC3=CC=C(C=C3)Br

Isomeric SMILES

C1CN(CCN1C2=C(C=C(C=C2)[N+](=O)[O-])Cl)C(=O)COC3=CC=C(C=C3)Br

InChI

InChI=1S/C18H17BrClN3O4/c19-13-1-4-15(5-2-13)27-12-18(24)22-9-7-21(8-10-22)17-6-3-14(23(25)26)11-16(17)20/h1-6,11H,7-10,12H2