2-(4-bromanylphenoxy)-2-methyl-1-[4-(4-nitrophenyl)piperazin-1-yl]propan-1-one

Systemtic Name: 2-(4-bromanylphenoxy)-2-methyl-1-[4-(4-nitrophenyl)piperazin-1-yl]propan-1-one Openeye Name: 2-(4-bromophenoxy)-2-methyl-1-[4-(4-nitrophenyl)piperazin-1-yl]propan-1-one CAS Name: 2-(4-bromophenoxy)-2-methyl-1-[4-(4-nitrophenyl)-1-piperazinyl]-1-propanone IUPAC Name: 2-(4-bromophenoxy)-2-methyl-1-[4-(4-nitrophenyl)piperazin-1-yl]propan-1-one Traditional Name: 2-(4-bromophenoxy)-2-methyl-1-[4-(4-nitrophenyl)piperazino]propan-1-one Formula: C20H22BrN3O4 MolecularWeight: 448.31038

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)N1CCN(CC1)C2=CC=C(C=C2)[N+](=O)[O-])OC3=CC=C(C=C3)Br

Isomeric SMILES

CC(C)(C(=O)N1CCN(CC1)C2=CC=C(C=C2)[N+](=O)[O-])OC3=CC=C(C=C3)Br

InChI

InChI=1S/C20H22BrN3O4/c1-20(2,28-18-9-3-15(21)4-10-18)19(25)23-13-11-22(12-14-23)16-5-7-17(8-6-16)24(26)27/h3-10H,11-14H2,1-2H3