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

Systemtic Name: 20-[[(E)-4-oxidanyl-4-oxidanylidene-but-2-enoyl]amino]icosanoic acid Openeye Name: 20-[[(E)-4-hydroxy-4-oxo-but-2-enoyl]amino]icosanoic acid CAS Name: 20-[[(E)-4-hydroxy-1,4-dioxobut-2-enyl]amino]eicosanoic acid IUPAC Name: 20-[[(E)-4-hydroxy-4-oxobut-2-enoyl]amino]icosanoic acid Traditional Name: 20-[[(E)-4-hydroxy-4-keto-but-2-enoyl]amino]arachidic acid Formula: C24H43NO5 MolecularWeight: 425.60192

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Descriptors Computed from Structure

Canonical SMILES:

C(CCCCCCCCCC(=O)O)CCCCCCCCCNC(=O)C=CC(=O)O

Isomeric SMILES

C(CCCCCCCCCC(=O)O)CCCCCCCCCNC(=O)/C=C/C(=O)O

InChI

InChI=1S/C24H43NO5/c26-22(19-20-24(29)30)25-21-17-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-16-18-23(27)28/h19-20H,1-18,21H2,(H,25,26)(H,27,28)(H,29,30)/b20-19+