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

Systemtic Name: 3-[(2R,4R,5R)-2-butyl-4,5-dimethyl-1-phenethyl-piperidin-4-yl]phenol Openeye Name: 3-[(2R,4R,5R)-2-butyl-4,5-dimethyl-1-phenethyl-4-piperidyl]phenol CAS Name: 3-[(2R,4R,5R)-2-butyl-4,5-dimethyl-1-phenethyl-4-piperidinyl]phenol IUPAC Name: 3-[(2R,4R,5R)-2-butyl-4,5-dimethyl-1-phenethylpiperidin-4-yl]phenol Traditional Name: 3-[(2R,4R,5R)-2-butyl-4,5-dimethyl-1-phenethyl-4-piperidyl]phenol Formula: C25H35NO MolecularWeight: 365.5515

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CC(C(CN1CCC2=CC=CC=C2)C)(C)C3=CC(=CC=C3)O

Isomeric SMILES

CCCC[C@@H]1C[C@@]([C@H](CN1CCC2=CC=CC=C2)C)(C)C3=CC(=CC=C3)O

InChI

InChI=1S/C25H35NO/c1-4-5-13-23-18-25(3,22-12-9-14-24(27)17-22)20(2)19-26(23)16-15-21-10-7-6-8-11-21/h6-12,14,17,20,23,27H,4-5,13,15-16,18-19H2,1-3H3/t20-,23+,25+/m0/s1