methyl 3-(4-hydroxyphenyl)-2-[[(5-oxidanylidenepyrrolidin-2-yl)carbonylamino]-(phenylcarbonyl)amino]propanoate

Systemtic Name: methyl 3-(4-hydroxyphenyl)-2-[[(5-oxidanylidenepyrrolidin-2-yl)carbonylamino]-(phenylcarbonyl)amino]propanoate Openeye Name: methyl 2-[benzoyl-[(5-oxopyrrolidine-2-carbonyl)amino]amino]-3-(4-hydroxyphenyl)propanoate CAS Name: 2-[benzoyl-[[oxo-(5-oxo-2-pyrrolidinyl)methyl]amino]amino]-3-(4-hydroxyphenyl)propanoic acid methyl ester IUPAC Name: methyl 2-[benzoyl-[(5-oxopyrrolidine-2-carbonyl)amino]amino]-3-(4-hydroxyphenyl)propanoate Traditional Name: 2-[benzoyl-(pyroglutamoylamino)amino]-3-(4-hydroxyphenyl)propionic acid methyl ester Formula: C22H23N3O6 MolecularWeight: 425.43452

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=C(C=C1)O)N(C(=O)C2=CC=CC=C2)NC(=O)C3CCC(=O)N3

Isomeric SMILES

COC(=O)C(CC1=CC=C(C=C1)O)N(C(=O)C2=CC=CC=C2)NC(=O)C3CCC(=O)N3

InChI

InChI=1S/C22H23N3O6/c1-31-22(30)18(13-14-7-9-16(26)10-8-14)25(21(29)15-5-3-2-4-6-15)24-20(28)17-11-12-19(27)23-17/h2-10,17-18,26H,11-13H2,1H3,(H,23,27)(H,24,28)