5-(3-hydroxyphenyl)-1-[2-(phenylmethoxycarbonylamino)ethanoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 5-(3-hydroxyphenyl)-1-[2-(phenylmethoxycarbonylamino)ethanoyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[2-(benzyloxycarbonylamino)acetyl]-5-(3-hydroxyphenyl)pyrrolidine-2-carboxylic acid CAS Name: 5-(3-hydroxyphenyl)-1-[1-oxo-2-(phenylmethoxycarbonylamino)ethyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 5-(3-hydroxyphenyl)-1-[2-(phenylmethoxycarbonylamino)acetyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[2-(benzyloxycarbonylamino)acetyl]-5-(3-hydroxyphenyl)proline Formula: C21H22N2O6 MolecularWeight: 398.40918

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1C2=CC(=CC=C2)O)C(=O)CNC(=O)OCC3=CC=CC=C3)C(=O)O

Isomeric SMILES

C1CC(N(C1C2=CC(=CC=C2)O)C(=O)CNC(=O)OCC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C21H22N2O6/c24-16-8-4-7-15(11-16)17-9-10-18(20(26)27)23(17)19(25)12-22-21(28)29-13-14-5-2-1-3-6-14/h1-8,11,17-18,24H,9-10,12-13H2,(H,22,28)(H,26,27)