1-[1-(phenylmethyl)pyrrolidin-1-ium-1-yl]ethyl 2,2,4,4-tetramethyl-1,3-oxazolidine-3-carboxylate

Systemtic Name: 1-[1-(phenylmethyl)pyrrolidin-1-ium-1-yl]ethyl 2,2,4,4-tetramethyl-1,3-oxazolidine-3-carboxylate Openeye Name: 1-(1-benzylpyrrolidin-1-ium-1-yl)ethyl 2,2,4,4-tetramethyloxazolidine-3-carboxylate CAS Name: 2,2,4,4-tetramethyl-3-oxazolidinecarboxylic acid 1-[1-(phenylmethyl)-1-pyrrolidin-1-iumyl]ethyl ester IUPAC Name: 1-(1-benzylpyrrolidin-1-ium-1-yl)ethyl 2,2,4,4-tetramethyl-1,3-oxazolidine-3-carboxylate Traditional Name: 2,2,4,4-tetramethyloxazolidine-3-carboxylic acid 1-(1-benzylpyrrolidin-1-ium-1-yl)ethyl ester Formula: C21H33N2O3+ MolecularWeight: 361.49832

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Descriptors Computed from Structure

Canonical SMILES:

CC([N+]1(CCCC1)CC2=CC=CC=C2)OC(=O)N3C(COC3(C)C)(C)C

Isomeric SMILES

CC([N+]1(CCCC1)CC2=CC=CC=C2)OC(=O)N3C(COC3(C)C)(C)C

InChI

InChI=1S/C21H33N2O3/c1-17(26-19(24)22-20(2,3)16-25-21(22,4)5)23(13-9-10-14-23)15-18-11-7-6-8-12-18/h6-8,11-12,17H,9-10,13-16H2,1-5H3/q+1