2-(3,5-dimethylphenoxy)-N-[2-(furan-2-yl)-2-pyrrolidin-1-ium-1-yl-ethyl]ethanamide chloride

Systemtic Name: 2-(3,5-dimethylphenoxy)-N-[2-(furan-2-yl)-2-pyrrolidin-1-ium-1-yl-ethyl]ethanamide chloride Openeye Name: 2-(3,5-dimethylphenoxy)-N-[2-(2-furyl)-2-pyrrolidin-1-ium-1-yl-ethyl]acetamide chloride CAS Name: 2-(3,5-dimethylphenoxy)-N-[2-(2-furanyl)-2-(1-pyrrolidin-1-iumyl)ethyl]acetamide chloride IUPAC Name: 2-(3,5-dimethylphenoxy)-N-[2-(furan-2-yl)-2-pyrrolidin-1-ium-1-ylethyl]acetamide chloride Traditional Name: 2-(3,5-dimethylphenoxy)-N-[2-(2-furyl)-2-pyrrolidin-1-ium-1-yl-ethyl]acetamide chloride Formula: C20H27ClN2O3 MolecularWeight: 378.89298

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCC(=O)NCC(C2=CC=CO2)[NH+]3CCCC3)C.[Cl-]

Isomeric SMILES

CC1=CC(=CC(=C1)OCC(=O)NCC(C2=CC=CO2)[NH+]3CCCC3)C.[Cl-]

InChI

InChI=1S/C20H26N2O3.ClH/c1-15-10-16(2)12-17(11-15)25-14-20(23)21-13-18(19-6-5-9-24-19)22-7-3-4-8-22;/h5-6,9-12,18H,3-4,7-8,13-14H2,1-2H3,(H,21,23);1H