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

Systemtic Name: 1-[4-[(3R,5S)-3,5-dimethyl-1-adamantyl]phenoxy]-3-piperidin-1-yl-propan-2-ol Openeye Name: 1-[4-[(3R,5S)-3,5-dimethyl-1-adamantyl]phenoxy]-3-(1-piperidyl)propan-2-ol CAS Name: 1-[4-[(3R,5S)-3,5-dimethyl-1-adamantyl]phenoxy]-3-(1-piperidinyl)-2-propanol IUPAC Name: 1-[4-[(3R,5S)-3,5-dimethyl-1-adamantyl]phenoxy]-3-piperidin-1-ylpropan-2-ol Traditional Name: 1-[4-[(3R,5S)-3,5-dimethyl-1-adamantyl]phenoxy]-3-piperidino-propan-2-ol Formula: C26H39NO2 MolecularWeight: 397.59336

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Descriptors Computed from Structure

Canonical SMILES:

CC12CC3CC(C1)(CC(C3)(C2)C4=CC=C(C=C4)OCC(CN5CCCCC5)O)C

Isomeric SMILES

C[C@@]12CC3C[C@@](C1)(CC(C3)(C2)C4=CC=C(C=C4)OCC(CN5CCCCC5)O)C

InChI

InChI=1S/C26H39NO2/c1-24-12-20-13-25(2,17-24)19-26(14-20,18-24)21-6-8-23(9-7-21)29-16-22(28)15-27-10-4-3-5-11-27/h6-9,20,22,28H,3-5,10-19H2,1-2H3/t20?,22?,24-,25+,26?