1-(4-tert-butylphenyl)-2-[3-(3,4-dichlorophenyl)pyrrolidin-1-yl]ethanone

Systemtic Name: 1-(4-tert-butylphenyl)-2-[3-(3,4-dichlorophenyl)pyrrolidin-1-yl]ethanone Openeye Name: 1-(4-tert-butylphenyl)-2-[3-(3,4-dichlorophenyl)pyrrolidin-1-yl]ethanone CAS Name: 1-(4-tert-butylphenyl)-2-[3-(3,4-dichlorophenyl)-1-pyrrolidinyl]ethanone IUPAC Name: 1-(4-tert-butylphenyl)-2-[3-(3,4-dichlorophenyl)pyrrolidin-1-yl]ethanone Traditional Name: 1-(4-tert-butylphenyl)-2-[3-(3,4-dichlorophenyl)pyrrolidino]ethanone Formula: C22H25Cl2NO MolecularWeight: 390.346

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)CN2CCC(C2)C3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)CN2CCC(C2)C3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C22H25Cl2NO/c1-22(2,3)18-7-4-15(5-8-18)21(26)14-25-11-10-17(13-25)16-6-9-19(23)20(24)12-16/h4-9,12,17H,10-11,13-14H2,1-3H3