[(2S)-1-(2-ethoxyethyl)-1-methyl-pyrrolidin-1-ium-2-yl]methyl 2-oxidanyl-2,2-diphenyl-ethanoate

Systemtic Name: [(2S)-1-(2-ethoxyethyl)-1-methyl-pyrrolidin-1-ium-2-yl]methyl 2-oxidanyl-2,2-diphenyl-ethanoate Openeye Name: [(2S)-1-(2-ethoxyethyl)-1-methyl-pyrrolidin-1-ium-2-yl]methyl 2-hydroxy-2,2-diphenyl-acetate CAS Name: 2-hydroxy-2,2-diphenylacetic acid [(2S)-1-(2-ethoxyethyl)-1-methyl-2-pyrrolidin-1-iumyl]methyl ester IUPAC Name: [(2S)-1-(2-ethoxyethyl)-1-methylpyrrolidin-1-ium-2-yl]methyl 2-hydroxy-2,2-diphenylacetate Traditional Name: 2-hydroxy-2,2-diphenyl-acetic acid [(2S)-1-(2-ethoxyethyl)-1-methyl-pyrrolidin-1-ium-2-yl]methyl ester Formula: C24H32NO4+ MolecularWeight: 398.51518

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOCC[N+]1(CCCC1COC(=O)C(C2=CC=CC=C2)(C3=CC=CC=C3)O)C

Isomeric SMILES

CCOCC[N+]1(CCC[C@H]1COC(=O)C(C2=CC=CC=C2)(C3=CC=CC=C3)O)C

InChI

InChI=1S/C24H32NO4/c1-3-28-18-17-25(2)16-10-15-22(25)19-29-23(26)24(27,20-11-6-4-7-12-20)21-13-8-5-9-14-21/h4-9,11-14,22,27H,3,10,15-19H2,1-2H3/q+1/t22-,25?/m0/s1