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

Systemtic Name: 1-[4-[4-(4-bromanyl-2-nitro-phenyl)piperazin-1-yl]phenyl]ethanone Openeye Name: 1-[4-[4-(4-bromo-2-nitro-phenyl)piperazin-1-yl]phenyl]ethanone CAS Name: 1-[4-[4-(4-bromo-2-nitrophenyl)-1-piperazinyl]phenyl]ethanone IUPAC Name: 1-[4-[4-(4-bromo-2-nitrophenyl)piperazin-1-yl]phenyl]ethanone Traditional Name: 1-[4-[4-(4-bromo-2-nitro-phenyl)piperazino]phenyl]ethanone Formula: C18H18BrN3O3 MolecularWeight: 404.25782

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)N2CCN(CC2)C3=C(C=C(C=C3)Br)[N+](=O)[O-]

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)N2CCN(CC2)C3=C(C=C(C=C3)Br)[N+](=O)[O-]

InChI

InChI=1S/C18H18BrN3O3/c1-13(23)14-2-5-16(6-3-14)20-8-10-21(11-9-20)17-7-4-15(19)12-18(17)22(24)25/h2-7,12H,8-11H2,1H3