1-cyclohexyl-4-(1-methylpiperidin-1-ium-1-yl)-1-phenyl-but-2-yn-1-ol

Systemtic Name: 1-cyclohexyl-4-(1-methylpiperidin-1-ium-1-yl)-1-phenyl-but-2-yn-1-ol Openeye Name: 1-cyclohexyl-4-(1-methylpiperidin-1-ium-1-yl)-1-phenyl-but-2-yn-1-ol CAS Name: 1-cyclohexyl-4-(1-methyl-1-piperidin-1-iumyl)-1-phenyl-2-butyn-1-ol IUPAC Name: 1-cyclohexyl-4-(1-methylpiperidin-1-ium-1-yl)-1-phenylbut-2-yn-1-ol Traditional Name: 1-cyclohexyl-4-(1-methylpiperidin-1-ium-1-yl)-1-phenyl-but-2-yn-1-ol Formula: C22H32NO+ MolecularWeight: 326.49558

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCCCC1)CC#CC(C2CCCCC2)(C3=CC=CC=C3)O

Isomeric SMILES

C[N+]1(CCCCC1)CC#CC(C2CCCCC2)(C3=CC=CC=C3)O

InChI

InChI=1S/C22H32NO/c1-23(17-9-4-10-18-23)19-11-16-22(24,20-12-5-2-6-13-20)21-14-7-3-8-15-21/h2,5-6,12-13,21,24H,3-4,7-10,14-15,17-19H2,1H3/q+1