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

Systemtic Name: 2-[[(E)-4-oxidanyl-4-oxidanylidene-but-2-enoyl]amino]hexanedioic acid Openeye Name: 2-[[(E)-4-hydroxy-4-oxo-but-2-enoyl]amino]hexanedioic acid CAS Name: 2-[[(E)-4-hydroxy-1,4-dioxobut-2-enyl]amino]hexanedioic acid IUPAC Name: 2-[[(E)-4-hydroxy-4-oxobut-2-enoyl]amino]hexanedioic acid Traditional Name: 2-[[(E)-4-hydroxy-4-keto-but-2-enoyl]amino]adipic acid Formula: C10H13NO7 MolecularWeight: 259.21272

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Descriptors Computed from Structure

Canonical SMILES:

C(CC(C(=O)O)NC(=O)C=CC(=O)O)CC(=O)O

Isomeric SMILES

C(CC(C(=O)O)NC(=O)/C=C/C(=O)O)CC(=O)O

InChI

InChI=1S/C10H13NO7/c12-7(4-5-9(15)16)11-6(10(17)18)2-1-3-8(13)14/h4-6H,1-3H2,(H,11,12)(H,13,14)(H,15,16)(H,17,18)/b5-4+