1-(tert-butylamino)-3-[4-[(3R,5S)-3,5-dimethyl-1-adamantyl]phenoxy]propan-2-ol

Systemtic Name: 1-(tert-butylamino)-3-[4-[(3R,5S)-3,5-dimethyl-1-adamantyl]phenoxy]propan-2-ol Openeye Name: 1-(tert-butylamino)-3-[4-[(3R,5S)-3,5-dimethyl-1-adamantyl]phenoxy]propan-2-ol CAS Name: 1-(tert-butylamino)-3-[4-[(3R,5S)-3,5-dimethyl-1-adamantyl]phenoxy]-2-propanol IUPAC Name: 1-(tert-butylamino)-3-[4-[(3R,5S)-3,5-dimethyl-1-adamantyl]phenoxy]propan-2-ol Traditional Name: 1-(tert-butylamino)-3-[4-[(3R,5S)-3,5-dimethyl-1-adamantyl]phenoxy]propan-2-ol Formula: C25H39NO2 MolecularWeight: 385.58266

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Descriptors Computed from Structure

Canonical SMILES:

CC12CC3CC(C1)(CC(C3)(C2)C4=CC=C(C=C4)OCC(CNC(C)(C)C)O)C

Isomeric SMILES

C[C@@]12CC3C[C@@](C1)(CC(C3)(C2)C4=CC=C(C=C4)OCC(CNC(C)(C)C)O)C

InChI

InChI=1S/C25H39NO2/c1-22(2,3)26-13-20(27)14-28-21-8-6-19(7-9-21)25-12-18-10-23(4,16-25)15-24(5,11-18)17-25/h6-9,18,20,26-27H,10-17H2,1-5H3/t18?,20?,23-,24+,25?