(1-propan-2-ylpyrrolidin-1-ium-2-yl)methyl 2-ethoxy-2,2-diphenyl-ethanoate chloride

Systemtic Name: (1-propan-2-ylpyrrolidin-1-ium-2-yl)methyl 2-ethoxy-2,2-diphenyl-ethanoate chloride Openeye Name: (1-isopropylpyrrolidin-1-ium-2-yl)methyl 2-ethoxy-2,2-diphenyl-acetate chloride CAS Name: 2-ethoxy-2,2-diphenylacetic acid (1-propan-2-yl-2-pyrrolidin-1-iumyl)methyl ester chloride IUPAC Name: (1-propan-2-ylpyrrolidin-1-ium-2-yl)methyl 2-ethoxy-2,2-diphenylacetate chloride Traditional Name: 2-ethoxy-2,2-diphenyl-acetic acid (1-isopropylpyrrolidin-1-ium-2-yl)methyl ester chloride Formula: C24H32ClNO3 MolecularWeight: 417.96878

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(C1=CC=CC=C1)(C2=CC=CC=C2)C(=O)OCC3CCC[NH+]3C(C)C.[Cl-]

Isomeric SMILES

CCOC(C1=CC=CC=C1)(C2=CC=CC=C2)C(=O)OCC3CCC[NH+]3C(C)C.[Cl-]

InChI

InChI=1S/C24H31NO3.ClH/c1-4-28-24(20-12-7-5-8-13-20,21-14-9-6-10-15-21)23(26)27-18-22-16-11-17-25(22)19(2)3;/h5-10,12-15,19,22H,4,11,16-18H2,1-3H3;1H