(2S)-3-[4-[2,5-bis(oxidanylidene)-3-phenyl-pyrrolidin-1-yl]phenyl]-2-[[(2S)-5-oxidanylidene-1-(phenylmethyl)pyrrolidin-2-yl]carbonylamino]propanoic acid

Systemtic Name: (2S)-3-[4-[2,5-bis(oxidanylidene)-3-phenyl-pyrrolidin-1-yl]phenyl]-2-[[(2S)-5-oxidanylidene-1-(phenylmethyl)pyrrolidin-2-yl]carbonylamino]propanoic acid Openeye Name: (2S)-2-[[(2S)-1-benzyl-5-oxo-pyrrolidine-2-carbonyl]amino]-3-[4-(2,5-dioxo-3-phenyl-pyrrolidin-1-yl)phenyl]propanoic acid CAS Name: (2S)-3-[4-(2,5-dioxo-3-phenyl-1-pyrrolidinyl)phenyl]-2-[[oxo-[(2S)-5-oxo-1-(phenylmethyl)-2-pyrrolidinyl]methyl]amino]propanoic acid IUPAC Name: (2S)-2-[[(2S)-1-benzyl-5-oxopyrrolidine-2-carbonyl]amino]-3-[4-(2,5-dioxo-3-phenylpyrrolidin-1-yl)phenyl]propanoic acid Traditional Name: (2S)-2-[[(2S)-1-benzyl-5-keto-prolyl]amino]-3-[4-(2,5-diketo-3-phenyl-pyrrolidino)phenyl]propionic acid Formula: C31H29N3O6 MolecularWeight: 539.57846

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1C(=O)NC(CC2=CC=C(C=C2)N3C(=O)CC(C3=O)C4=CC=CC=C4)C(=O)O)CC5=CC=CC=C5

Isomeric SMILES

C1CC(=O)N([C@@H]1C(=O)N[C@@H](CC2=CC=C(C=C2)N3C(=O)CC(C3=O)C4=CC=CC=C4)C(=O)O)CC5=CC=CC=C5

InChI

InChI=1S/C31H29N3O6/c35-27-16-15-26(33(27)19-21-7-3-1-4-8-21)29(37)32-25(31(39)40)17-20-11-13-23(14-12-20)34-28(36)18-24(30(34)38)22-9-5-2-6-10-22/h1-14,24-26H,15-19H2,(H,32,37)(H,39,40)/t24?,25-,26-/m0/s1