3,5-dimethyl-2,6-diphenyl-4-(2-phenylethynyl)piperidin-4-ol hydrochloride

Systemtic Name: 3,5-dimethyl-2,6-diphenyl-4-(2-phenylethynyl)piperidin-4-ol hydrochloride Openeye Name: 3,5-dimethyl-2,6-diphenyl-4-(2-phenylethynyl)piperidin-4-ol hydrochloride CAS Name: 3,5-dimethyl-2,6-diphenyl-4-(2-phenylethynyl)-4-piperidinol hydrochloride IUPAC Name: 3,5-dimethyl-2,6-diphenyl-4-(2-phenylethynyl)piperidin-4-ol hydrochloride Traditional Name: 3,5-dimethyl-2,6-diphenyl-4-(2-phenylethynyl)piperidin-4-ol hydrochloride Formula: C27H28ClNO MolecularWeight: 417.97032

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(NC(C(C1(C#CC2=CC=CC=C2)O)C)C3=CC=CC=C3)C4=CC=CC=C4.Cl

Isomeric SMILES

CC1C(NC(C(C1(C#CC2=CC=CC=C2)O)C)C3=CC=CC=C3)C4=CC=CC=C4.Cl

InChI

InChI=1S/C27H27NO.ClH/c1-20-25(23-14-8-4-9-15-23)28-26(24-16-10-5-11-17-24)21(2)27(20,29)19-18-22-12-6-3-7-13-22;/h3-17,20-21,25-26,28-29H,1-2H3;1H