3-acetamido-4-(2-ethylphenyl)-2-oxidanyl-4-oxidanylidene-butanoic acid

Systemtic Name: 3-acetamido-4-(2-ethylphenyl)-2-oxidanyl-4-oxidanylidene-butanoic acid Openeye Name: 3-acetamido-4-(2-ethylphenyl)-2-hydroxy-4-oxo-butanoic acid CAS Name: 3-acetamido-4-(2-ethylphenyl)-2-hydroxy-4-oxobutanoic acid IUPAC Name: 3-acetamido-4-(2-ethylphenyl)-2-hydroxy-4-oxobutanoic acid Traditional Name: 3-acetamido-4-(2-ethylphenyl)-2-hydroxy-4-keto-butyric acid Formula: C14H17NO5 MolecularWeight: 279.28848

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1C(=O)C(C(C(=O)O)O)NC(=O)C

Isomeric SMILES

CCC1=CC=CC=C1C(=O)C(C(C(=O)O)O)NC(=O)C

InChI

InChI=1S/C14H17NO5/c1-3-9-6-4-5-7-10(9)12(17)11(15-8(2)16)13(18)14(19)20/h4-7,11,13,18H,3H2,1-2H3,(H,15,16)(H,19,20)