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

Systemtic Name: 3-(1H-imidazol-5-yl)-2-[(5-oxidanylidene-1-phenylmethoxycarbonyl-pyrrolidin-2-yl)carbonylamino]propanoic acid Openeye Name: 2-[(1-benzyloxycarbonyl-5-oxo-pyrrolidine-2-carbonyl)amino]-3-(1H-imidazol-5-yl)propanoic acid CAS Name: 3-(1H-imidazol-5-yl)-2-[[oxo-(5-oxo-1-phenylmethoxycarbonyl-2-pyrrolidinyl)methyl]amino]propanoic acid IUPAC Name: 3-(1H-imidazol-5-yl)-2-[(5-oxo-1-phenylmethoxycarbonylpyrrolidine-2-carbonyl)amino]propanoic acid Traditional Name: 2-[(1-carbobenzoxy-5-keto-prolyl)amino]-3-(1H-imidazol-5-yl)propionic acid Formula: C19H20N4O6 MolecularWeight: 400.3853

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1C(=O)NC(CC2=CN=CN2)C(=O)O)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

C1CC(=O)N(C1C(=O)NC(CC2=CN=CN2)C(=O)O)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C19H20N4O6/c24-16-7-6-15(23(16)19(28)29-10-12-4-2-1-3-5-12)17(25)22-14(18(26)27)8-13-9-20-11-21-13/h1-5,9,11,14-15H,6-8,10H2,(H,20,21)(H,22,25)(H,26,27)