2-(4-bromanylphenoxy)-2-methyl-1-[4-(3-morpholin-4-yl-4-nitro-phenyl)piperazin-1-yl]propan-1-one

Systemtic Name: 2-(4-bromanylphenoxy)-2-methyl-1-[4-(3-morpholin-4-yl-4-nitro-phenyl)piperazin-1-yl]propan-1-one Openeye Name: 2-(4-bromophenoxy)-2-methyl-1-[4-(3-morpholino-4-nitro-phenyl)piperazin-1-yl]propan-1-one CAS Name: 2-(4-bromophenoxy)-2-methyl-1-[4-[3-(4-morpholinyl)-4-nitrophenyl]-1-piperazinyl]-1-propanone IUPAC Name: 2-(4-bromophenoxy)-2-methyl-1-[4-(3-morpholin-4-yl-4-nitrophenyl)piperazin-1-yl]propan-1-one Traditional Name: 2-(4-bromophenoxy)-2-methyl-1-[4-(3-morpholino-4-nitro-phenyl)piperazino]propan-1-one Formula: C24H29BrN4O5 MolecularWeight: 533.41486

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)N1CCN(CC1)C2=CC(=C(C=C2)[N+](=O)[O-])N3CCOCC3)OC4=CC=C(C=C4)Br

Isomeric SMILES

CC(C)(C(=O)N1CCN(CC1)C2=CC(=C(C=C2)[N+](=O)[O-])N3CCOCC3)OC4=CC=C(C=C4)Br

InChI

InChI=1S/C24H29BrN4O5/c1-24(2,34-20-6-3-18(25)4-7-20)23(30)28-11-9-26(10-12-28)19-5-8-21(29(31)32)22(17-19)27-13-15-33-16-14-27/h3-8,17H,9-16H2,1-2H3