(2R)-2-(carboxycarbonylamino)-3-[4-(3-oxidanylidenebutan-2-yloxy)phenyl]propanoic acid

Systemtic Name: (2R)-2-(carboxycarbonylamino)-3-[4-(3-oxidanylidenebutan-2-yloxy)phenyl]propanoic acid Openeye Name: (2R)-3-[4-(1-methyl-2-oxo-propoxy)phenyl]-2-(oxaloamino)propanoic acid CAS Name: (2R)-2-(oxaloamino)-3-[4-(3-oxobutan-2-yloxy)phenyl]propanoic acid IUPAC Name: (2R)-2-(oxaloamino)-3-[4-(3-oxobutan-2-yloxy)phenyl]propanoic acid Traditional Name: (2R)-3-[4-(2-keto-1-methyl-propoxy)phenyl]-2-(oxaloamino)propionic acid Formula: C15H17NO7 MolecularWeight: 323.29798

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C)OC1=CC=C(C=C1)CC(C(=O)O)NC(=O)C(=O)O

Isomeric SMILES

CC(C(=O)C)OC1=CC=C(C=C1)C[C@H](C(=O)O)NC(=O)C(=O)O

InChI

InChI=1S/C15H17NO7/c1-8(17)9(2)23-11-5-3-10(4-6-11)7-12(14(19)20)16-13(18)15(21)22/h3-6,9,12H,7H2,1-2H3,(H,16,18)(H,19,20)(H,21,22)/t9?,12-/m1/s1