3-(1H-imidazol-5-yl)-2-[2-oxidanylidene-3-(phenylmethoxycarbonylamino)-3-(phenylmethyl)pyrrolidin-1-yl]propanoic acid

Systemtic Name: 3-(1H-imidazol-5-yl)-2-[2-oxidanylidene-3-(phenylmethoxycarbonylamino)-3-(phenylmethyl)pyrrolidin-1-yl]propanoic acid Openeye Name: 2-[3-benzyl-3-(benzyloxycarbonylamino)-2-oxo-pyrrolidin-1-yl]-3-(1H-imidazol-5-yl)propanoic acid CAS Name: 3-(1H-imidazol-5-yl)-2-[2-oxo-3-(phenylmethoxycarbonylamino)-3-(phenylmethyl)-1-pyrrolidinyl]propanoic acid IUPAC Name: 2-[3-benzyl-2-oxo-3-(phenylmethoxycarbonylamino)pyrrolidin-1-yl]-3-(1H-imidazol-5-yl)propanoic acid Traditional Name: 2-[3-benzyl-3-(benzyloxycarbonylamino)-2-keto-pyrrolidino]-3-(1H-imidazol-5-yl)propionic acid Formula: C25H26N4O5 MolecularWeight: 462.49774

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=O)C1(CC2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3)C(CC4=CN=CN4)C(=O)O

Isomeric SMILES

C1CN(C(=O)C1(CC2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3)C(CC4=CN=CN4)C(=O)O

InChI

InChI=1S/C25H26N4O5/c30-22(31)21(13-20-15-26-17-27-20)29-12-11-25(23(29)32,14-18-7-3-1-4-8-18)28-24(33)34-16-19-9-5-2-6-10-19/h1-10,15,17,21H,11-14,16H2,(H,26,27)(H,28,33)(H,30,31)