2-(3-bromanylphenoxy)-1-[4-(4-chloranyl-2-nitro-phenyl)piperazin-1-yl]ethanone

Systemtic Name: 2-(3-bromanylphenoxy)-1-[4-(4-chloranyl-2-nitro-phenyl)piperazin-1-yl]ethanone Openeye Name: 2-(3-bromophenoxy)-1-[4-(4-chloro-2-nitro-phenyl)piperazin-1-yl]ethanone CAS Name: 2-(3-bromophenoxy)-1-[4-(4-chloro-2-nitrophenyl)-1-piperazinyl]ethanone IUPAC Name: 2-(3-bromophenoxy)-1-[4-(4-chloro-2-nitrophenyl)piperazin-1-yl]ethanone Traditional Name: 2-(3-bromophenoxy)-1-[4-(4-chloro-2-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)Cl)[N+](=O)[O-])C(=O)COC3=CC(=CC=C3)Br

Isomeric SMILES

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

InChI

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