3-[2-(4-bromophenyl)phenyl]-2,3-dimethyl-1-pyrrolidin-1-yl-butane-1,2-diol

Systemtic Name: 3-[2-(4-bromophenyl)phenyl]-2,3-dimethyl-1-pyrrolidin-1-yl-butane-1,2-diol Openeye Name: 3-[2-(4-bromophenyl)phenyl]-2,3-dimethyl-1-pyrrolidin-1-yl-butane-1,2-diol CAS Name: 3-[2-(4-bromophenyl)phenyl]-2,3-dimethyl-1-(1-pyrrolidinyl)butane-1,2-diol IUPAC Name: 3-[2-(4-bromophenyl)phenyl]-2,3-dimethyl-1-pyrrolidin-1-ylbutane-1,2-diol Traditional Name: 3-[2-(4-bromophenyl)phenyl]-2,3-dimethyl-1-pyrrolidino-butane-1,2-diol Formula: C22H28BrNO2 MolecularWeight: 418.36722

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CC=CC=C1C2=CC=C(C=C2)Br)C(C)(C(N3CCCC3)O)O

Isomeric SMILES

CC(C)(C1=CC=CC=C1C2=CC=C(C=C2)Br)C(C)(C(N3CCCC3)O)O

InChI

InChI=1S/C22H28BrNO2/c1-21(2,22(3,26)20(25)24-14-6-7-15-24)19-9-5-4-8-18(19)16-10-12-17(23)13-11-16/h4-5,8-13,20,25-26H,6-7,14-15H2,1-3H3