(2-bromophenyl)-[4-(4-fluoranyl-2-nitro-5-pyrrolidin-1-yl-phenyl)piperazin-1-yl]methanone

Systemtic Name: (2-bromophenyl)-[4-(4-fluoranyl-2-nitro-5-pyrrolidin-1-yl-phenyl)piperazin-1-yl]methanone Openeye Name: (2-bromophenyl)-[4-(4-fluoro-2-nitro-5-pyrrolidin-1-yl-phenyl)piperazin-1-yl]methanone CAS Name: (2-bromophenyl)-[4-[4-fluoro-2-nitro-5-(1-pyrrolidinyl)phenyl]-1-piperazinyl]methanone IUPAC Name: (2-bromophenyl)-[4-(4-fluoro-2-nitro-5-pyrrolidin-1-ylphenyl)piperazin-1-yl]methanone Traditional Name: (2-bromophenyl)-[4-(4-fluoro-2-nitro-5-pyrrolidino-phenyl)piperazino]methanone Formula: C21H22BrFN4O3 MolecularWeight: 477.326783

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=C(C(=C2)N3CCN(CC3)C(=O)C4=CC=CC=C4Br)[N+](=O)[O-])F

Isomeric SMILES

C1CCN(C1)C2=C(C=C(C(=C2)N3CCN(CC3)C(=O)C4=CC=CC=C4Br)[N+](=O)[O-])F

InChI

InChI=1S/C21H22BrFN4O3/c22-16-6-2-1-5-15(16)21(28)26-11-9-25(10-12-26)19-14-18(24-7-3-4-8-24)17(23)13-20(19)27(29)30/h1-2,5-6,13-14H,3-4,7-12H2