(2R,3R)-3-phenethylpyrrolidin-1-ium-2-carboxylic acid chloride

Systemtic Name: (2R,3R)-3-phenethylpyrrolidin-1-ium-2-carboxylic acid chloride Openeye Name: (2R,3R)-3-phenethylpyrrolidin-1-ium-2-carboxylic acid chloride CAS Name: (2R,3R)-3-phenethyl-2-pyrrolidin-1-iumcarboxylic acid chloride IUPAC Name: (2R,3R)-3-phenethylpyrrolidin-1-ium-2-carboxylic acid chloride Traditional Name: (2R,3R)-3-phenethylpyrrolidin-1-ium-2-carboxylic acid chloride Formula: C13H18ClNO2 MolecularWeight: 255.74052

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C[NH2+]C(C1CCC2=CC=CC=C2)C(=O)O.[Cl-]

Isomeric SMILES

C1C[NH2+][C@H]([C@@H]1CCC2=CC=CC=C2)C(=O)O.[Cl-]

InChI

InChI=1S/C13H17NO2.ClH/c15-13(16)12-11(8-9-14-12)7-6-10-4-2-1-3-5-10;/h1-5,11-12,14H,6-9H2,(H,15,16);1H/t11-,12-;/m1./s1