(1,2,6-trimethylpiperidin-1-ium-4-yl) 2,2-diphenylethanoate chloride

Systemtic Name: (1,2,6-trimethylpiperidin-1-ium-4-yl) 2,2-diphenylethanoate chloride Openeye Name: (1,2,6-trimethylpiperidin-1-ium-4-yl) 2,2-diphenylacetate chloride CAS Name: 2,2-diphenylacetic acid (1,2,6-trimethyl-4-piperidin-1-iumyl) ester chloride IUPAC Name: (1,2,6-trimethylpiperidin-1-ium-4-yl) 2,2-diphenylacetate chloride Traditional Name: 2,2-diphenylacetic acid (1,2,6-trimethylpiperidin-1-ium-4-yl) ester chloride Formula: C22H28ClNO2 MolecularWeight: 373.91622

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CC([NH+]1C)C)OC(=O)C(C2=CC=CC=C2)C3=CC=CC=C3.[Cl-]

Isomeric SMILES

CC1CC(CC([NH+]1C)C)OC(=O)C(C2=CC=CC=C2)C3=CC=CC=C3.[Cl-]

InChI

InChI=1S/C22H27NO2.ClH/c1-16-14-20(15-17(2)23(16)3)25-22(24)21(18-10-6-4-7-11-18)19-12-8-5-9-13-19;/h4-13,16-17,20-21H,14-15H2,1-3H3;1H