3-[(3R,4S)-1-hexan-2-yl-3,4-dimethyl-piperidin-4-yl]phenol hydrochloride

Systemtic Name: 3-[(3R,4S)-1-hexan-2-yl-3,4-dimethyl-piperidin-4-yl]phenol hydrochloride Openeye Name: 3-[(3R,4S)-3,4-dimethyl-1-(1-methylpentyl)-4-piperidyl]phenol hydrochloride CAS Name: 3-[(3R,4S)-1-hexan-2-yl-3,4-dimethyl-4-piperidinyl]phenol hydrochloride IUPAC Name: 3-[(3R,4S)-1-hexan-2-yl-3,4-dimethylpiperidin-4-yl]phenol hydrochloride Traditional Name: 3-[(3R,4S)-3,4-dimethyl-1-(1-methylpentyl)-4-piperidyl]phenol hydrochloride Formula: C19H32ClNO MolecularWeight: 325.91648

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C)N1CCC(C(C1)C)(C)C2=CC(=CC=C2)O.Cl

Isomeric SMILES

CCCCC(C)N1CC[C@]([C@H](C1)C)(C)C2=CC(=CC=C2)O.Cl

InChI

InChI=1S/C19H31NO.ClH/c1-5-6-8-16(3)20-12-11-19(4,15(2)14-20)17-9-7-10-18(21)13-17;/h7,9-10,13,15-16,21H,5-6,8,11-12,14H2,1-4H3;1H/t15-,16?,19-;/m0./s1