1-[2-[carboxymethyl(phenylmethoxycarbonyl)amino]propanoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[2-[carboxymethyl(phenylmethoxycarbonyl)amino]propanoyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[2-[benzyloxycarbonyl(carboxymethyl)amino]propanoyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[2-[carboxymethyl(phenylmethoxycarbonyl)amino]-1-oxopropyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[2-[carboxymethyl(phenylmethoxycarbonyl)amino]propanoyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[2-[carbobenzoxy(carboxymethyl)amino]propanoyl]proline Formula: C18H22N2O7 MolecularWeight: 378.37648

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCCC1C(=O)O)N(CC(=O)O)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(C(=O)N1CCCC1C(=O)O)N(CC(=O)O)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C18H22N2O7/c1-12(16(23)19-9-5-8-14(19)17(24)25)20(10-15(21)22)18(26)27-11-13-6-3-2-4-7-13/h2-4,6-7,12,14H,5,8-11H2,1H3,(H,21,22)(H,24,25)