2-[[[(E)-4-oxidanyl-4-oxidanylidene-but-2-enoyl]amino]methyl]butanoic acid

Systemtic Name: 2-[[[(E)-4-oxidanyl-4-oxidanylidene-but-2-enoyl]amino]methyl]butanoic acid Openeye Name: 2-[[[(E)-4-hydroxy-4-oxo-but-2-enoyl]amino]methyl]butanoic acid CAS Name: 2-[[[(E)-4-hydroxy-1,4-dioxobut-2-enyl]amino]methyl]butanoic acid IUPAC Name: 2-[[[(E)-4-hydroxy-4-oxobut-2-enoyl]amino]methyl]butanoic acid Traditional Name: 2-[[[(E)-4-hydroxy-4-keto-but-2-enoyl]amino]methyl]butyric acid Formula: C9H13NO5 MolecularWeight: 215.20322

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CNC(=O)C=CC(=O)O)C(=O)O

Isomeric SMILES

CCC(CNC(=O)/C=C/C(=O)O)C(=O)O

InChI

InChI=1S/C9H13NO5/c1-2-6(9(14)15)5-10-7(11)3-4-8(12)13/h3-4,6H,2,5H2,1H3,(H,10,11)(H,12,13)(H,14,15)/b4-3+