1-(4-bromophenyl)-4-[4-(2,3-dihydro-1,4-benzodioxin-3-ylcarbonyl)piperazin-1-yl]butane-1,4-dione

Systemtic Name: 1-(4-bromophenyl)-4-[4-(2,3-dihydro-1,4-benzodioxin-3-ylcarbonyl)piperazin-1-yl]butane-1,4-dione Openeye Name: 1-(4-bromophenyl)-4-[4-(2,3-dihydro-1,4-benzodioxine-3-carbonyl)piperazin-1-yl]butane-1,4-dione CAS Name: 1-(4-bromophenyl)-4-[4-[2,3-dihydro-1,4-benzodioxin-3-yl(oxo)methyl]-1-piperazinyl]butane-1,4-dione IUPAC Name: 1-(4-bromophenyl)-4-[4-(2,3-dihydro-1,4-benzodioxine-3-carbonyl)piperazin-1-yl]butane-1,4-dione Traditional Name: 1-(4-bromophenyl)-4-[4-(2,3-dihydro-1,4-benzodioxin-3-carbonyl)piperazino]butane-1,4-dione Formula: C23H23BrN2O5 MolecularWeight: 487.34312

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CCC(=O)C2=CC=C(C=C2)Br)C(=O)C3COC4=CC=CC=C4O3

Isomeric SMILES

C1CN(CCN1C(=O)CCC(=O)C2=CC=C(C=C2)Br)C(=O)C3COC4=CC=CC=C4O3

InChI

InChI=1S/C23H23BrN2O5/c24-17-7-5-16(6-8-17)18(27)9-10-22(28)25-11-13-26(14-12-25)23(29)21-15-30-19-3-1-2-4-20(19)31-21/h1-8,21H,9-15H2