(1-methylpiperidin-1-ium-3-yl) 2,2-diphenylethanoate chloride

Systemtic Name: (1-methylpiperidin-1-ium-3-yl) 2,2-diphenylethanoate chloride Openeye Name: (1-methylpiperidin-1-ium-3-yl) 2,2-diphenylacetate chloride CAS Name: 2,2-diphenylacetic acid (1-methyl-3-piperidin-1-iumyl) ester chloride IUPAC Name: (1-methylpiperidin-1-ium-3-yl) 2,2-diphenylacetate chloride Traditional Name: 2,2-diphenylacetic acid (1-methylpiperidin-1-ium-3-yl) ester chloride Formula: C20H24ClNO2 MolecularWeight: 345.86306

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCCC(C1)OC(=O)C(C2=CC=CC=C2)C3=CC=CC=C3.[Cl-]

Isomeric SMILES

C[NH+]1CCCC(C1)OC(=O)C(C2=CC=CC=C2)C3=CC=CC=C3.[Cl-]

InChI

InChI=1S/C20H23NO2.ClH/c1-21-14-8-13-18(15-21)23-20(22)19(16-9-4-2-5-10-16)17-11-6-3-7-12-17;/h2-7,9-12,18-19H,8,13-15H2,1H3;1H