(3R,5S)-5-[bis(3,5-dimethylphenyl)-oxidanyl-methyl]-1-methyl-pyrrolidin-3-ol

Systemtic Name: (3R,5S)-5-[bis(3,5-dimethylphenyl)-oxidanyl-methyl]-1-methyl-pyrrolidin-3-ol Openeye Name: (3R,5S)-5-[bis(3,5-dimethylphenyl)-hydroxy-methyl]-1-methyl-pyrrolidin-3-ol CAS Name: (3R,5S)-5-[bis(3,5-dimethylphenyl)-hydroxymethyl]-1-methyl-3-pyrrolidinol IUPAC Name: (3R,5S)-5-[bis(3,5-dimethylphenyl)-hydroxymethyl]-1-methylpyrrolidin-3-ol Traditional Name: (3R,5S)-5-[bis(3,5-dimethylphenyl)-hydroxy-methyl]-1-methyl-pyrrolidin-3-ol Formula: C22H29NO2 MolecularWeight: 339.47116

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C(C2CC(CN2C)O)(C3=CC(=CC(=C3)C)C)O)C

Isomeric SMILES

CC1=CC(=CC(=C1)C([C@@H]2C[C@H](CN2C)O)(C3=CC(=CC(=C3)C)C)O)C

InChI

InChI=1S/C22H29NO2/c1-14-6-15(2)9-18(8-14)22(25,21-12-20(24)13-23(21)5)19-10-16(3)7-17(4)11-19/h6-11,20-21,24-25H,12-13H2,1-5H3/t20-,21+/m1/s1