methyl (2S)-1-(triphenylmethyl)pyrrolidin-1-ium-2-carboxylate

Systemtic Name: methyl (2S)-1-(triphenylmethyl)pyrrolidin-1-ium-2-carboxylate Openeye Name: methyl (2S)-1-tritylpyrrolidin-1-ium-2-carboxylate CAS Name: (2S)-1-(triphenylmethyl)-2-pyrrolidin-1-iumcarboxylic acid methyl ester IUPAC Name: methyl (2S)-1-tritylpyrrolidin-1-ium-2-carboxylate Traditional Name: (2S)-1-tritylpyrrolidin-1-ium-2-carboxylic acid methyl ester Formula: C25H26NO2+ MolecularWeight: 372.47944

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCC[NH+]1C(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

COC(=O)[C@@H]1CCC[NH+]1C(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H25NO2/c1-28-24(27)23-18-11-19-26(23)25(20-12-5-2-6-13-20,21-14-7-3-8-15-21)22-16-9-4-10-17-22/h2-10,12-17,23H,11,18-19H2,1H3/p+1/t23-/m0/s1