(1-methylpiperidin-1-ium-3-yl) 2-methoxy-2,2-diphenyl-ethanoate chloride

Systemtic Name: (1-methylpiperidin-1-ium-3-yl) 2-methoxy-2,2-diphenyl-ethanoate chloride Openeye Name: (1-methylpiperidin-1-ium-3-yl) 2-methoxy-2,2-diphenyl-acetate chloride CAS Name: 2-methoxy-2,2-diphenylacetic acid (1-methyl-3-piperidin-1-iumyl) ester chloride IUPAC Name: (1-methylpiperidin-1-ium-3-yl) 2-methoxy-2,2-diphenylacetate chloride Traditional Name: 2-methoxy-2,2-diphenyl-acetic acid (1-methylpiperidin-1-ium-3-yl) ester chloride Formula: C21H26ClNO3 MolecularWeight: 375.88904

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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)OC.[Cl-]

Isomeric SMILES

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

InChI

InChI=1S/C21H25NO3.ClH/c1-22-15-9-14-19(16-22)25-20(23)21(24-2,17-10-5-3-6-11-17)18-12-7-4-8-13-18;/h3-8,10-13,19H,9,14-16H2,1-2H3;1H