3-(4-hydroxyphenyl)-2-[[(5-oxidanylidenepyrrolidin-2-yl)carbonylamino]-(phenylcarbonyl)amino]propanoic acid

Systemtic Name: 3-(4-hydroxyphenyl)-2-[[(5-oxidanylidenepyrrolidin-2-yl)carbonylamino]-(phenylcarbonyl)amino]propanoic acid Openeye Name: 2-[benzoyl-[(5-oxopyrrolidine-2-carbonyl)amino]amino]-3-(4-hydroxyphenyl)propanoic acid CAS Name: 2-[benzoyl-[[oxo-(5-oxo-2-pyrrolidinyl)methyl]amino]amino]-3-(4-hydroxyphenyl)propanoic acid IUPAC Name: 2-[benzoyl-[(5-oxopyrrolidine-2-carbonyl)amino]amino]-3-(4-hydroxyphenyl)propanoic acid Traditional Name: 2-[benzoyl-(pyroglutamoylamino)amino]-3-(4-hydroxyphenyl)propionic acid Formula: C21H21N3O6 MolecularWeight: 411.40794

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)NC1C(=O)NN(C(CC2=CC=C(C=C2)O)C(=O)O)C(=O)C3=CC=CC=C3

Isomeric SMILES

C1CC(=O)NC1C(=O)NN(C(CC2=CC=C(C=C2)O)C(=O)O)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H21N3O6/c25-15-8-6-13(7-9-15)12-17(21(29)30)24(20(28)14-4-2-1-3-5-14)23-19(27)16-10-11-18(26)22-16/h1-9,16-17,25H,10-12H2,(H,22,26)(H,23,27)(H,29,30)