9-[4-[1-(phenylmethyl)piperidin-1-ium-1-yl]but-2-ynyl]fluoren-9-ol chloride

Systemtic Name: 9-[4-[1-(phenylmethyl)piperidin-1-ium-1-yl]but-2-ynyl]fluoren-9-ol chloride Openeye Name: 9-[4-(1-benzylpiperidin-1-ium-1-yl)but-2-ynyl]fluoren-9-ol chloride CAS Name: 9-[4-[1-(phenylmethyl)-1-piperidin-1-iumyl]but-2-ynyl]-9-fluorenol chloride IUPAC Name: 9-[4-(1-benzylpiperidin-1-ium-1-yl)but-2-ynyl]fluoren-9-ol chloride Traditional Name: 9-[4-(1-benzylpiperidin-1-ium-1-yl)but-2-ynyl]fluoren-9-ol chloride Formula: C29H30ClNO MolecularWeight: 444.0076

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[N+](CC1)(CC#CCC2(C3=CC=CC=C3C4=CC=CC=C42)O)CC5=CC=CC=C5.[Cl-]

Isomeric SMILES

C1CC[N+](CC1)(CC#CCC2(C3=CC=CC=C3C4=CC=CC=C42)O)CC5=CC=CC=C5.[Cl-]

InChI

InChI=1S/C29H30NO.ClH/c31-29(27-17-7-5-15-25(27)26-16-6-8-18-28(26)29)19-9-12-22-30(20-10-2-11-21-30)23-24-13-3-1-4-14-24;/h1,3-8,13-18,31H,2,10-11,19-23H2;1H/q+1;/p-1