4-[5-[[4-(hydroxymethyl)-4-(3-phenylpropyl)piperidin-1-yl]methyl]thiophen-2-yl]-2-methyl-but-3-yn-2-ol

Systemtic Name: 4-[5-[[4-(hydroxymethyl)-4-(3-phenylpropyl)piperidin-1-yl]methyl]thiophen-2-yl]-2-methyl-but-3-yn-2-ol Openeye Name: 4-[5-[[4-(hydroxymethyl)-4-(3-phenylpropyl)-1-piperidyl]methyl]-2-thienyl]-2-methyl-but-3-yn-2-ol CAS Name: 4-[5-[[4-(hydroxymethyl)-4-(3-phenylpropyl)-1-piperidinyl]methyl]-2-thiophenyl]-2-methyl-3-butyn-2-ol IUPAC Name: 4-[5-[[4-(hydroxymethyl)-4-(3-phenylpropyl)piperidin-1-yl]methyl]thiophen-2-yl]-2-methylbut-3-yn-2-ol Traditional Name: 2-methyl-4-[5-[[4-methylol-4-(3-phenylpropyl)piperidino]methyl]-2-thienyl]but-3-yn-2-ol Formula: C25H33NO2S MolecularWeight: 411.60002

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C#CC1=CC=C(S1)CN2CCC(CC2)(CCCC3=CC=CC=C3)CO)O

Isomeric SMILES

CC(C)(C#CC1=CC=C(S1)CN2CCC(CC2)(CCCC3=CC=CC=C3)CO)O

InChI

InChI=1S/C25H33NO2S/c1-24(2,28)14-12-22-10-11-23(29-22)19-26-17-15-25(20-27,16-18-26)13-6-9-21-7-4-3-5-8-21/h3-5,7-8,10-11,27-28H,6,9,13,15-20H2,1-2H3