1-(4-bromophenyl)-4-[4-(2-fluorophenyl)carbonylpiperazin-1-yl]butane-1,4-dione

Systemtic Name: 1-(4-bromophenyl)-4-[4-(2-fluorophenyl)carbonylpiperazin-1-yl]butane-1,4-dione Openeye Name: 1-(4-bromophenyl)-4-[4-(2-fluorobenzoyl)piperazin-1-yl]butane-1,4-dione CAS Name: 1-(4-bromophenyl)-4-[4-[(2-fluorophenyl)-oxomethyl]-1-piperazinyl]butane-1,4-dione IUPAC Name: 1-(4-bromophenyl)-4-[4-(2-fluorobenzoyl)piperazin-1-yl]butane-1,4-dione Traditional Name: 1-(4-bromophenyl)-4-[4-(2-fluorobenzoyl)piperazino]butane-1,4-dione Formula: C21H20BrFN2O3 MolecularWeight: 447.297503

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CCC(=O)C2=CC=C(C=C2)Br)C(=O)C3=CC=CC=C3F

Isomeric SMILES

C1CN(CCN1C(=O)CCC(=O)C2=CC=C(C=C2)Br)C(=O)C3=CC=CC=C3F

InChI

InChI=1S/C21H20BrFN2O3/c22-16-7-5-15(6-8-16)19(26)9-10-20(27)24-11-13-25(14-12-24)21(28)17-3-1-2-4-18(17)23/h1-8H,9-14H2