(2R)-1-[4-[[(phenylmethyl)-pyridin-3-ylcarbonyl-amino]methyl]phenyl]carbonylpyrrolidine-2-carboxylic acid

Systemtic Name: (2R)-1-[4-[[(phenylmethyl)-pyridin-3-ylcarbonyl-amino]methyl]phenyl]carbonylpyrrolidine-2-carboxylic acid Openeye Name: (2R)-1-[4-[[benzyl(pyridine-3-carbonyl)amino]methyl]benzoyl]pyrrolidine-2-carboxylic acid CAS Name: (2R)-1-[oxo-[4-[[[oxo(3-pyridinyl)methyl]-(phenylmethyl)amino]methyl]phenyl]methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: (2R)-1-[4-[[benzyl(pyridine-3-carbonyl)amino]methyl]benzoyl]pyrrolidine-2-carboxylic acid Traditional Name: (2R)-1-[4-[[benzyl(nicotinoyl)amino]methyl]benzoyl]proline Formula: C26H25N3O4 MolecularWeight: 443.4944

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C2=CC=C(C=C2)CN(CC3=CC=CC=C3)C(=O)C4=CN=CC=C4)C(=O)O

Isomeric SMILES

C1C[C@@H](N(C1)C(=O)C2=CC=C(C=C2)CN(CC3=CC=CC=C3)C(=O)C4=CN=CC=C4)C(=O)O

InChI

InChI=1S/C26H25N3O4/c30-24(22-8-4-14-27-16-22)28(17-19-6-2-1-3-7-19)18-20-10-12-21(13-11-20)25(31)29-15-5-9-23(29)26(32)33/h1-4,6-8,10-14,16,23H,5,9,15,17-18H2,(H,32,33)/t23-/m1/s1