2-fluoranyl-5-methoxy-2-[1-methyl-1-(phenylmethyl)piperidin-1-ium-4-yl]-3H-inden-1-one hydrochloride

Systemtic Name: 2-fluoranyl-5-methoxy-2-[1-methyl-1-(phenylmethyl)piperidin-1-ium-4-yl]-3H-inden-1-one hydrochloride Openeye Name: 2-(1-benzyl-1-methyl-piperidin-1-ium-4-yl)-2-fluoro-5-methoxy-indan-1-one hydrochloride CAS Name: 2-fluoro-5-methoxy-2-[1-methyl-1-(phenylmethyl)-4-piperidin-1-iumyl]-3H-inden-1-one hydrochloride IUPAC Name: 2-(1-benzyl-1-methylpiperidin-1-ium-4-yl)-2-fluoro-5-methoxy-3H-inden-1-one hydrochloride Traditional Name: 2-(1-benzyl-1-methyl-piperidin-1-ium-4-yl)-2-fluoro-5-methoxy-indan-1-one hydrochloride Formula: C23H28ClFNO2+ MolecularWeight: 404.925323

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCC(CC1)C2(CC3=C(C2=O)C=CC(=C3)OC)F)CC4=CC=CC=C4.Cl

Isomeric SMILES

C[N+]1(CCC(CC1)C2(CC3=C(C2=O)C=CC(=C3)OC)F)CC4=CC=CC=C4.Cl

InChI

InChI=1S/C23H27FNO2.ClH/c1-25(16-17-6-4-3-5-7-17)12-10-19(11-13-25)23(24)15-18-14-20(27-2)8-9-21(18)22(23)26;/h3-9,14,19H,10-13,15-16H2,1-2H3;1H/q+1;