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

Systemtic Name: 4-(1-methyl-4,4-diphenyl-piperidin-1-ium-1-yl)-1,1-diphenyl-but-2-yn-1-ol Openeye Name: 4-(1-methyl-4,4-diphenyl-piperidin-1-ium-1-yl)-1,1-diphenyl-but-2-yn-1-ol CAS Name: 4-(1-methyl-4,4-diphenyl-1-piperidin-1-iumyl)-1,1-diphenyl-2-butyn-1-ol IUPAC Name: 4-(1-methyl-4,4-diphenylpiperidin-1-ium-1-yl)-1,1-diphenylbut-2-yn-1-ol Traditional Name: 4-(1-methyl-4,4-diphenyl-piperidin-1-ium-1-yl)-1,1-diphenyl-but-2-yn-1-ol Formula: C34H34NO+ MolecularWeight: 472.63986

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCC(CC1)(C2=CC=CC=C2)C3=CC=CC=C3)CC#CC(C4=CC=CC=C4)(C5=CC=CC=C5)O

Isomeric SMILES

C[N+]1(CCC(CC1)(C2=CC=CC=C2)C3=CC=CC=C3)CC#CC(C4=CC=CC=C4)(C5=CC=CC=C5)O

InChI

InChI=1S/C34H34NO/c1-35(26-14-23-34(36,31-19-10-4-11-20-31)32-21-12-5-13-22-32)27-24-33(25-28-35,29-15-6-2-7-16-29)30-17-8-3-9-18-30/h2-13,15-22,36H,24-28H2,1H3/q+1