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

Systemtic Name: (1-methylpyrrolidin-1-ium-1-yl)methyl 2,2-diphenylpropanoate Openeye Name: (1-methylpyrrolidin-1-ium-1-yl)methyl 2,2-diphenylpropanoate CAS Name: 2,2-diphenylpropanoic acid (1-methyl-1-pyrrolidin-1-iumyl)methyl ester IUPAC Name: (1-methylpyrrolidin-1-ium-1-yl)methyl 2,2-diphenylpropanoate Traditional Name: 2,2-diphenylpropionic acid (1-methylpyrrolidin-1-ium-1-yl)methyl ester Formula: C21H26NO2+ MolecularWeight: 324.43664

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26NO2/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/q+1