ethyl (2S,4R,5S)-4-(phenylmethyl)-5-prop-2-enyl-pyrrolidine-2-carboxylate

Systemtic Name: ethyl (2S,4R,5S)-4-(phenylmethyl)-5-prop-2-enyl-pyrrolidine-2-carboxylate Openeye Name: ethyl (2S,4R,5S)-5-allyl-4-benzyl-pyrrolidine-2-carboxylate CAS Name: (2S,4R,5S)-4-(phenylmethyl)-5-prop-2-enyl-2-pyrrolidinecarboxylic acid ethyl ester IUPAC Name: ethyl (2S,4R,5S)-4-benzyl-5-prop-2-enylpyrrolidine-2-carboxylate Traditional Name: (2S,4R,5S)-5-allyl-4-benzyl-pyrrolidine-2-carboxylic acid ethyl ester Formula: C17H23NO2 MolecularWeight: 273.37002

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CC(C(N1)CC=C)CC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)[C@@H]1C[C@H]([C@@H](N1)CC=C)CC2=CC=CC=C2

InChI

InChI=1S/C17H23NO2/c1-3-8-15-14(11-13-9-6-5-7-10-13)12-16(18-15)17(19)20-4-2/h3,5-7,9-10,14-16,18H,1,4,8,11-12H2,2H3/t14-,15+,16+/m1/s1