(E)-2-ethyl-4-hexoxy-4-oxidanylidene-but-2-enoic acid

Systemtic Name: (E)-2-ethyl-4-hexoxy-4-oxidanylidene-but-2-enoic acid Openeye Name: (E)-2-ethyl-4-hexoxy-4-oxo-but-2-enoic acid CAS Name: (E)-2-ethyl-4-hexoxy-4-oxo-2-butenoic acid IUPAC Name: (E)-2-ethyl-4-hexoxy-4-oxobut-2-enoic acid Traditional Name: (E)-2-ethyl-4-hexoxy-4-keto-but-2-enoic acid Formula: C12H20O4 MolecularWeight: 228.2848

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)C=C(CC)C(=O)O

Isomeric SMILES

CCCCCCOC(=O)/C=C(\CC)/C(=O)O

InChI

InChI=1S/C12H20O4/c1-3-5-6-7-8-16-11(13)9-10(4-2)12(14)15/h9H,3-8H2,1-2H3,(H,14,15)/b10-9+