2-(4-bromanylphenoxy)-1-[4-(2-chloranyl-6-nitro-phenyl)piperazin-1-yl]ethanone

Systemtic Name: 2-(4-bromanylphenoxy)-1-[4-(2-chloranyl-6-nitro-phenyl)piperazin-1-yl]ethanone Openeye Name: 2-(4-bromophenoxy)-1-[4-(2-chloro-6-nitro-phenyl)piperazin-1-yl]ethanone CAS Name: 2-(4-bromophenoxy)-1-[4-(2-chloro-6-nitrophenyl)-1-piperazinyl]ethanone IUPAC Name: 2-(4-bromophenoxy)-1-[4-(2-chloro-6-nitrophenyl)piperazin-1-yl]ethanone Traditional Name: 2-(4-bromophenoxy)-1-[4-(2-chloro-6-nitro-phenyl)piperazino]ethanone Formula: C18H17BrClN3O4 MolecularWeight: 454.70228

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=CC=C2Cl)[N+](=O)[O-])C(=O)COC3=CC=C(C=C3)Br

Isomeric SMILES

C1CN(CCN1C2=C(C=CC=C2Cl)[N+](=O)[O-])C(=O)COC3=CC=C(C=C3)Br

InChI

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