1-(4-bromophenyl)-4-[2-(2,5-dimethoxyphenyl)pyrrolidin-1-yl]butane-1,4-dione

Systemtic Name: 1-(4-bromophenyl)-4-[2-(2,5-dimethoxyphenyl)pyrrolidin-1-yl]butane-1,4-dione Openeye Name: 1-(4-bromophenyl)-4-[2-(2,5-dimethoxyphenyl)pyrrolidin-1-yl]butane-1,4-dione CAS Name: 1-(4-bromophenyl)-4-[2-(2,5-dimethoxyphenyl)-1-pyrrolidinyl]butane-1,4-dione IUPAC Name: 1-(4-bromophenyl)-4-[2-(2,5-dimethoxyphenyl)pyrrolidin-1-yl]butane-1,4-dione Traditional Name: 1-(4-bromophenyl)-4-[2-(2,5-dimethoxyphenyl)pyrrolidino]butane-1,4-dione Formula: C22H24BrNO4 MolecularWeight: 446.33426

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)C2CCCN2C(=O)CCC(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

COC1=CC(=C(C=C1)OC)C2CCCN2C(=O)CCC(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C22H24BrNO4/c1-27-17-9-11-21(28-2)18(14-17)19-4-3-13-24(19)22(26)12-10-20(25)15-5-7-16(23)8-6-15/h5-9,11,14,19H,3-4,10,12-13H2,1-2H3