ethyl (2S,4S)-4-iodanyl-1-(phenylmethyl)pyrrolidine-2-carboxylate

Systemtic Name: ethyl (2S,4S)-4-iodanyl-1-(phenylmethyl)pyrrolidine-2-carboxylate Openeye Name: ethyl (2S,4S)-1-benzyl-4-iodo-pyrrolidine-2-carboxylate CAS Name: (2S,4S)-4-iodo-1-(phenylmethyl)-2-pyrrolidinecarboxylic acid ethyl ester IUPAC Name: ethyl (2S,4S)-1-benzyl-4-iodopyrrolidine-2-carboxylate Traditional Name: (2S,4S)-1-benzyl-4-iodo-pyrrolidine-2-carboxylic acid ethyl ester Formula: C14H18INO2 MolecularWeight: 359.20269

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CC(CN1CC2=CC=CC=C2)I

Isomeric SMILES

CCOC(=O)[C@@H]1C[C@@H](CN1CC2=CC=CC=C2)I

InChI

InChI=1S/C14H18INO2/c1-2-18-14(17)13-8-12(15)10-16(13)9-11-6-4-3-5-7-11/h3-7,12-13H,2,8-10H2,1H3/t12-,13-/m0/s1