1-(4-bromophenyl)-4-[4-(2,3-dimethylphenyl)piperazin-1-yl]butane-1,4-dione

Systemtic Name: 1-(4-bromophenyl)-4-[4-(2,3-dimethylphenyl)piperazin-1-yl]butane-1,4-dione Openeye Name: 1-(4-bromophenyl)-4-[4-(2,3-dimethylphenyl)piperazin-1-yl]butane-1,4-dione CAS Name: 1-(4-bromophenyl)-4-[4-(2,3-dimethylphenyl)-1-piperazinyl]butane-1,4-dione IUPAC Name: 1-(4-bromophenyl)-4-[4-(2,3-dimethylphenyl)piperazin-1-yl]butane-1,4-dione Traditional Name: 1-(4-bromophenyl)-4-[4-(2,3-dimethylphenyl)piperazino]butane-1,4-dione Formula: C22H25BrN2O2 MolecularWeight: 429.3501

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)CCC(=O)C3=CC=C(C=C3)Br)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)CCC(=O)C3=CC=C(C=C3)Br)C

InChI

InChI=1S/C22H25BrN2O2/c1-16-4-3-5-20(17(16)2)24-12-14-25(15-13-24)22(27)11-10-21(26)18-6-8-19(23)9-7-18/h3-9H,10-15H2,1-2H3