(1-methylpyrrolidin-1-ium-1-yl)methyl 2,2-diphenylpropanoate chloride

Systemtic Name: (1-methylpyrrolidin-1-ium-1-yl)methyl 2,2-diphenylpropanoate chloride Openeye Name: (1-methylpyrrolidin-1-ium-1-yl)methyl 2,2-diphenylpropanoate chloride CAS Name: 2,2-diphenylpropanoic acid (1-methyl-1-pyrrolidin-1-iumyl)methyl ester chloride IUPAC Name: (1-methylpyrrolidin-1-ium-1-yl)methyl 2,2-diphenylpropanoate chloride Traditional Name: 2,2-diphenylpropionic acid (1-methylpyrrolidin-1-ium-1-yl)methyl ester chloride Formula: C21H26ClNO2 MolecularWeight: 359.88964

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)(C2=CC=CC=C2)C(=O)OC[N+]3(CCCC3)C.[Cl-]

Isomeric SMILES

CC(C1=CC=CC=C1)(C2=CC=CC=C2)C(=O)OC[N+]3(CCCC3)C.[Cl-]

InChI

InChI=1S/C21H26NO2.ClH/c1-21(18-11-5-3-6-12-18,19-13-7-4-8-14-19)20(23)24-17-22(2)15-9-10-16-22;/h3-8,11-14H,9-10,15-17H2,1-2H3;1H/q+1;/p-1