ethyl 2-[1-[2-(2-phenoxyethanoyloxy)-2-phenyl-ethyl]pyrrolidin-1-ium-1-yl]ethanoate bromide

Systemtic Name: ethyl 2-[1-[2-(2-phenoxyethanoyloxy)-2-phenyl-ethyl]pyrrolidin-1-ium-1-yl]ethanoate bromide Openeye Name: ethyl 2-[1-[2-(2-phenoxyacetyl)oxy-2-phenyl-ethyl]pyrrolidin-1-ium-1-yl]acetate bromide CAS Name: 2-[1-[2-(1-oxo-2-phenoxyethoxy)-2-phenylethyl]-1-pyrrolidin-1-iumyl]acetic acid ethyl ester bromide IUPAC Name: ethyl 2-[1-[2-(2-phenoxyacetyl)oxy-2-phenylethyl]pyrrolidin-1-ium-1-yl]acetate bromide Traditional Name: 2-[1-[2-(2-phenoxyacetyl)oxy-2-phenyl-ethyl]pyrrolidin-1-ium-1-yl]acetic acid ethyl ester bromide Formula: C24H30BrNO5 MolecularWeight: 492.4027

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C[N+]1(CCCC1)CC(C2=CC=CC=C2)OC(=O)COC3=CC=CC=C3.[Br-]

Isomeric SMILES

CCOC(=O)C[N+]1(CCCC1)CC(C2=CC=CC=C2)OC(=O)COC3=CC=CC=C3.[Br-]

InChI

InChI=1S/C24H30NO5.BrH/c1-2-28-23(26)18-25(15-9-10-16-25)17-22(20-11-5-3-6-12-20)30-24(27)19-29-21-13-7-4-8-14-21;/h3-8,11-14,22H,2,9-10,15-19H2,1H3;1H/q+1;/p-1