8-[[(Z)-4-oxidanyl-4-oxidanylidene-but-2-enoyl]amino]octanoic acid

Systemtic Name: 8-[[(Z)-4-oxidanyl-4-oxidanylidene-but-2-enoyl]amino]octanoic acid Openeye Name: 8-[[(Z)-4-hydroxy-4-oxo-but-2-enoyl]amino]octanoic acid CAS Name: 8-[[(Z)-4-hydroxy-1,4-dioxobut-2-enyl]amino]octanoic acid IUPAC Name: 8-[[(Z)-4-hydroxy-4-oxobut-2-enoyl]amino]octanoic acid Traditional Name: 8-[[(Z)-4-hydroxy-4-keto-but-2-enoyl]amino]caprylic acid Formula: C12H19NO5 MolecularWeight: 261.268044

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Descriptors Computed from Structure

Canonical SMILES:

C(CCCC(=O)O)CCCNC(=O)C=CC(=O)O

Isomeric SMILES

C(CCCC(=O)O)CCCNC(=O)/[14CH]=[14CH]\C(=O)O

InChI

InChI=1S/C12H19NO5/c14-10(7-8-12(17)18)13-9-5-3-1-2-4-6-11(15)16/h7-8H,1-6,9H2,(H,13,14)(H,15,16)(H,17,18)/b8-7-/i7+2,8+2