4-methyl-2,6-bis[[(2R)-2-[oxidanyl-bis(4-phenylphenyl)methyl]pyrrolidin-1-yl]methyl]phenol

Systemtic Name: 4-methyl-2,6-bis[[(2R)-2-[oxidanyl-bis(4-phenylphenyl)methyl]pyrrolidin-1-yl]methyl]phenol Openeye Name: 2,6-bis[[(2R)-2-[hydroxy-bis(4-phenylphenyl)methyl]pyrrolidin-1-yl]methyl]-4-methyl-phenol CAS Name: 2,6-bis[[(2R)-2-[hydroxy-bis(4-phenylphenyl)methyl]-1-pyrrolidinyl]methyl]-4-methylphenol IUPAC Name: 2,6-bis[[(2R)-2-[hydroxy-bis(4-phenylphenyl)methyl]pyrrolidin-1-yl]methyl]-4-methylphenol Traditional Name: 2,6-bis[[(2R)-2-[hydroxy-bis(4-phenylphenyl)methyl]pyrrolidino]methyl]-4-methyl-phenol Formula: C67H62N2O3 MolecularWeight: 943.22078

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)CN2CCCC2C(C3=CC=C(C=C3)C4=CC=CC=C4)(C5=CC=C(C=C5)C6=CC=CC=C6)O)O)CN7CCCC7C(C8=CC=C(C=C8)C9=CC=CC=C9)(C1=CC=C(C=C1)C1=CC=CC=C1)O

Isomeric SMILES

CC1=CC(=C(C(=C1)CN2CCC[C@@H]2C(C3=CC=C(C=C3)C4=CC=CC=C4)(C5=CC=C(C=C5)C6=CC=CC=C6)O)O)CN7CCC[C@@H]7C(C8=CC=C(C=C8)C9=CC=CC=C9)(C1=CC=C(C=C1)C1=CC=CC=C1)O

InChI

InChI=1S/C67H62N2O3/c1-48-44-57(46-68-42-14-24-63(68)66(71,59-34-26-53(27-35-59)49-16-6-2-7-17-49)60-36-28-54(29-37-60)50-18-8-3-9-19-50)65(70)58(45-48)47-69-43-15-25-64(69)67(72,61-38-30-55(31-39-61)51-20-10-4-11-21-51)62-40-32-56(33-41-62)52-22-12-5-13-23-52/h2-13,16-23,26-41,44-45,63-64,70-72H,14-15,24-25,42-43,46-47H2,1H3/t63-,64-/m1/s1