2-(4-bromophenyl)-1-[2-(3,4-dimethoxyphenyl)pyrrolidin-1-yl]ethanone

Systemtic Name: 2-(4-bromophenyl)-1-[2-(3,4-dimethoxyphenyl)pyrrolidin-1-yl]ethanone Openeye Name: 2-(4-bromophenyl)-1-[2-(3,4-dimethoxyphenyl)pyrrolidin-1-yl]ethanone CAS Name: 2-(4-bromophenyl)-1-[2-(3,4-dimethoxyphenyl)-1-pyrrolidinyl]ethanone IUPAC Name: 2-(4-bromophenyl)-1-[2-(3,4-dimethoxyphenyl)pyrrolidin-1-yl]ethanone Traditional Name: 2-(4-bromophenyl)-1-[2-(3,4-dimethoxyphenyl)pyrrolidino]ethanone Formula: C20H22BrNO3 MolecularWeight: 404.29758

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2CCCN2C(=O)CC3=CC=C(C=C3)Br)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2CCCN2C(=O)CC3=CC=C(C=C3)Br)OC

InChI

InChI=1S/C20H22BrNO3/c1-24-18-10-7-15(13-19(18)25-2)17-4-3-11-22(17)20(23)12-14-5-8-16(21)9-6-14/h5-10,13,17H,3-4,11-12H2,1-2H3