(2R,3R,4S)-4-ethynyl-2,3-dimethyl-1-(3-phenylprop-2-ynyl)piperidin-4-ol hydrochloride

Systemtic Name: (2R,3R,4S)-4-ethynyl-2,3-dimethyl-1-(3-phenylprop-2-ynyl)piperidin-4-ol hydrochloride Openeye Name: (2R,3R,4S)-4-ethynyl-2,3-dimethyl-1-(3-phenylprop-2-ynyl)piperidin-4-ol hydrochloride CAS Name: (2R,3R,4S)-4-ethynyl-2,3-dimethyl-1-(3-phenylprop-2-ynyl)-4-piperidinol hydrochloride IUPAC Name: (2R,3R,4S)-4-ethynyl-2,3-dimethyl-1-(3-phenylprop-2-ynyl)piperidin-4-ol hydrochloride Traditional Name: (2R,3R,4S)-4-ethynyl-2,3-dimethyl-1-(3-phenylprop-2-ynyl)piperidin-4-ol hydrochloride Formula: C18H22ClNO MolecularWeight: 303.82638

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1C(N(CCC1(C#C)O)CC#CC2=CC=CC=C2)C.Cl

Isomeric SMILES

C[C@@H]1[C@H](N(CC[C@]1(C#C)O)CC#CC2=CC=CC=C2)C.Cl

InChI

InChI=1S/C18H21NO.ClH/c1-4-18(20)12-14-19(16(3)15(18)2)13-8-11-17-9-6-5-7-10-17;/h1,5-7,9-10,15-16,20H,12-14H2,2-3H3;1H/t15-,16-,18+;/m1./s1