5-(2-aminocarbonyl-4-phenyl-phenoxy)-4-oxidanylidene-3-(prop-2-enoxycarbonylamino)pentanoic acid

Systemtic Name: 5-(2-aminocarbonyl-4-phenyl-phenoxy)-4-oxidanylidene-3-(prop-2-enoxycarbonylamino)pentanoic acid Openeye Name: 3-(allyloxycarbonylamino)-5-(2-carbamoyl-4-phenyl-phenoxy)-4-oxo-pentanoic acid CAS Name: 5-(2-carbamoyl-4-phenylphenoxy)-4-oxo-3-[[oxo(prop-2-enoxy)methyl]amino]pentanoic acid IUPAC Name: 5-(2-carbamoyl-4-phenylphenoxy)-4-oxo-3-(prop-2-enoxycarbonylamino)pentanoic acid Traditional Name: 3-(allyloxycarbonylamino)-5-(2-carbamoyl-4-phenyl-phenoxy)-4-keto-valeric acid Formula: C22H22N2O7 MolecularWeight: 426.41928

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Descriptors Computed from Structure

Canonical SMILES:

C=CCOC(=O)NC(CC(=O)O)C(=O)COC1=C(C=C(C=C1)C2=CC=CC=C2)C(=O)N

Isomeric SMILES

C=CCOC(=O)NC(CC(=O)O)C(=O)COC1=C(C=C(C=C1)C2=CC=CC=C2)C(=O)N

InChI

InChI=1S/C22H22N2O7/c1-2-10-30-22(29)24-17(12-20(26)27)18(25)13-31-19-9-8-15(11-16(19)21(23)28)14-6-4-3-5-7-14/h2-9,11,17H,1,10,12-13H2,(H2,23,28)(H,24,29)(H,26,27)