4-(2-methyl-1-propyl-piperidin-1-ium-1-yl)-1,1-diphenyl-but-2-yn-1-ol

Systemtic Name: 4-(2-methyl-1-propyl-piperidin-1-ium-1-yl)-1,1-diphenyl-but-2-yn-1-ol Openeye Name: 4-(2-methyl-1-propyl-piperidin-1-ium-1-yl)-1,1-diphenyl-but-2-yn-1-ol CAS Name: 4-(2-methyl-1-propyl-1-piperidin-1-iumyl)-1,1-diphenyl-2-butyn-1-ol IUPAC Name: 4-(2-methyl-1-propylpiperidin-1-ium-1-yl)-1,1-diphenylbut-2-yn-1-ol Traditional Name: 4-(2-methyl-1-propyl-piperidin-1-ium-1-yl)-1,1-diphenyl-but-2-yn-1-ol Formula: C25H32NO+ MolecularWeight: 362.52768

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Descriptors Computed from Structure

Canonical SMILES:

CCC[N+]1(CCCCC1C)CC#CC(C2=CC=CC=C2)(C3=CC=CC=C3)O

Isomeric SMILES

CCC[N+]1(CCCCC1C)CC#CC(C2=CC=CC=C2)(C3=CC=CC=C3)O

InChI

InChI=1S/C25H32NO/c1-3-19-26(20-11-10-13-22(26)2)21-12-18-25(27,23-14-6-4-7-15-23)24-16-8-5-9-17-24/h4-9,14-17,22,27H,3,10-11,13,19-21H2,1-2H3/q+1