3-[(2R,4R,5R)-1-hexyl-4,5-dimethyl-2-propyl-piperidin-4-yl]phenol

Systemtic Name: 3-[(2R,4R,5R)-1-hexyl-4,5-dimethyl-2-propyl-piperidin-4-yl]phenol Openeye Name: 3-[(2R,4R,5R)-1-hexyl-4,5-dimethyl-2-propyl-4-piperidyl]phenol CAS Name: 3-[(2R,4R,5R)-1-hexyl-4,5-dimethyl-2-propyl-4-piperidinyl]phenol IUPAC Name: 3-[(2R,4R,5R)-1-hexyl-4,5-dimethyl-2-propylpiperidin-4-yl]phenol Traditional Name: 3-[(2R,4R,5R)-1-hexyl-4,5-dimethyl-2-propyl-4-piperidyl]phenol Formula: C22H37NO MolecularWeight: 331.53528

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1CC(C(CC1CCC)(C)C2=CC(=CC=C2)O)C

Isomeric SMILES

CCCCCCN1C[C@@H]([C@](C[C@H]1CCC)(C)C2=CC(=CC=C2)O)C

InChI

InChI=1S/C22H37NO/c1-5-7-8-9-14-23-17-18(3)22(4,16-20(23)11-6-2)19-12-10-13-21(24)15-19/h10,12-13,15,18,20,24H,5-9,11,14,16-17H2,1-4H3/t18-,20+,22+/m0/s1