tert-butyl 1-[1-(4-methoxycarbonylphenoxy)ethyl]pyrrolidin-1-ium-1-carboxylate

Systemtic Name: tert-butyl 1-[1-(4-methoxycarbonylphenoxy)ethyl]pyrrolidin-1-ium-1-carboxylate Openeye Name: tert-butyl 1-[1-(4-methoxycarbonylphenoxy)ethyl]pyrrolidin-1-ium-1-carboxylate CAS Name: 1-[1-(4-methoxycarbonylphenoxy)ethyl]-1-pyrrolidin-1-iumcarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 1-[1-(4-methoxycarbonylphenoxy)ethyl]pyrrolidin-1-ium-1-carboxylate Traditional Name: 1-[1-(4-carbomethoxyphenoxy)ethyl]pyrrolidin-1-ium-1-carboxylic acid tert-butyl ester Formula: C19H28NO5+ MolecularWeight: 350.42932

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC([N+]1(CCCC1)C(=O)OC(C)(C)C)OC2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

CC([N+]1(CCCC1)C(=O)OC(C)(C)C)OC2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C19H28NO5/c1-14(24-16-10-8-15(9-11-16)17(21)23-5)20(12-6-7-13-20)18(22)25-19(2,3)4/h8-11,14H,6-7,12-13H2,1-5H3/q+1