(phenylmethyl) (2S)-2-(2-oxidanylpropylcarbamoyl)pyrrolidine-1-carboxylate

Systemtic Name: (phenylmethyl) (2S)-2-(2-oxidanylpropylcarbamoyl)pyrrolidine-1-carboxylate Openeye Name: benzyl (2S)-2-(2-hydroxypropylcarbamoyl)pyrrolidine-1-carboxylate CAS Name: (2S)-2-[(2-hydroxypropylamino)-oxomethyl]-1-pyrrolidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (2S)-2-(2-hydroxypropylcarbamoyl)pyrrolidine-1-carboxylate Traditional Name: (2S)-2-(2-hydroxypropylcarbamoyl)pyrrolidine-1-carboxylic acid benzyl ester Formula: C16H22N2O4 MolecularWeight: 306.35688

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CNC(=O)C1CCCN1C(=O)OCC2=CC=CC=C2)O

Isomeric SMILES

CC(CNC(=O)[C@@H]1CCCN1C(=O)OCC2=CC=CC=C2)O

InChI

InChI=1S/C16H22N2O4/c1-12(19)10-17-15(20)14-8-5-9-18(14)16(21)22-11-13-6-3-2-4-7-13/h2-4,6-7,12,14,19H,5,8-11H2,1H3,(H,17,20)/t12?,14-/m0/s1