2-(1-methylpyrrolidin-1-ium-2-yl)ethyl 2-methoxy-2,2-diphenyl-ethanoate chloride

Systemtic Name: 2-(1-methylpyrrolidin-1-ium-2-yl)ethyl 2-methoxy-2,2-diphenyl-ethanoate chloride Openeye Name: 2-(1-methylpyrrolidin-1-ium-2-yl)ethyl 2-methoxy-2,2-diphenyl-acetate chloride CAS Name: 2-methoxy-2,2-diphenylacetic acid 2-(1-methyl-2-pyrrolidin-1-iumyl)ethyl ester chloride IUPAC Name: 2-(1-methylpyrrolidin-1-ium-2-yl)ethyl 2-methoxy-2,2-diphenylacetate chloride Traditional Name: 2-methoxy-2,2-diphenyl-acetic acid 2-(1-methylpyrrolidin-1-ium-2-yl)ethyl ester chloride Formula: C22H28ClNO3 MolecularWeight: 389.91562

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCCC1CCOC(=O)C(C2=CC=CC=C2)(C3=CC=CC=C3)OC.[Cl-]

Isomeric SMILES

C[NH+]1CCCC1CCOC(=O)C(C2=CC=CC=C2)(C3=CC=CC=C3)OC.[Cl-]

InChI

InChI=1S/C22H27NO3.ClH/c1-23-16-9-14-20(23)15-17-26-21(24)22(25-2,18-10-5-3-6-11-18)19-12-7-4-8-13-19;/h3-8,10-13,20H,9,14-17H2,1-2H3;1H