1-(4-bromophenyl)-4-[4-(phenylmethyl)piperazin-1-yl]butane-1,4-dione

Systemtic Name: 1-(4-bromophenyl)-4-[4-(phenylmethyl)piperazin-1-yl]butane-1,4-dione Openeye Name: 1-(4-benzylpiperazin-1-yl)-4-(4-bromophenyl)butane-1,4-dione CAS Name: 1-(4-bromophenyl)-4-[4-(phenylmethyl)-1-piperazinyl]butane-1,4-dione IUPAC Name: 1-(4-benzylpiperazin-1-yl)-4-(4-bromophenyl)butane-1,4-dione Traditional Name: 1-(4-benzylpiperazino)-4-(4-bromophenyl)butane-1,4-dione Formula: C21H23BrN2O2 MolecularWeight: 415.32352

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C(=O)CCC(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C(=O)CCC(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C21H23BrN2O2/c22-19-8-6-18(7-9-19)20(25)10-11-21(26)24-14-12-23(13-15-24)16-17-4-2-1-3-5-17/h1-9H,10-16H2