4-[[[(Z)-4-oxidanyl-4-oxidanylidene-but-2-enoyl]amino]methyl]cyclohexane-1-carboxylic acid

Systemtic Name: 4-[[[(Z)-4-oxidanyl-4-oxidanylidene-but-2-enoyl]amino]methyl]cyclohexane-1-carboxylic acid Openeye Name: 4-[[[(Z)-4-hydroxy-4-oxo-but-2-enoyl]amino]methyl]cyclohexanecarboxylic acid CAS Name: 4-[[[(Z)-4-hydroxy-1,4-dioxobut-2-enyl]amino]methyl]-1-cyclohexanecarboxylic acid IUPAC Name: 4-[[[(Z)-4-hydroxy-4-oxobut-2-enoyl]amino]methyl]cyclohexane-1-carboxylic acid Traditional Name: 4-[[[(Z)-4-hydroxy-4-keto-but-2-enoyl]amino]methyl]cyclohexanecarboxylic acid Formula: C12H17NO5 MolecularWeight: 255.26708

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1CNC(=O)C=CC(=O)O)C(=O)O

Isomeric SMILES

C1CC(CCC1CNC(=O)/C=C\C(=O)O)C(=O)O

InChI

InChI=1S/C12H17NO5/c14-10(5-6-11(15)16)13-7-8-1-3-9(4-2-8)12(17)18/h5-6,8-9H,1-4,7H2,(H,13,14)(H,15,16)(H,17,18)/b6-5-