(1-ethylpyrrolidin-1-ium-2-yl)methyl 2-methoxy-2,2-diphenyl-ethanoate chloride

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

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCCC1COC(=O)C(C2=CC=CC=C2)(C3=CC=CC=C3)OC.[Cl-]

Isomeric SMILES

CC[NH+]1CCCC1COC(=O)C(C2=CC=CC=C2)(C3=CC=CC=C3)OC.[Cl-]

InChI

InChI=1S/C22H27NO3.ClH/c1-3-23-16-10-15-20(23)17-26-21(24)22(25-2,18-11-6-4-7-12-18)19-13-8-5-9-14-19;/h4-9,11-14,20H,3,10,15-17H2,1-2H3;1H