(E)-4-octan-3-yloxy-4-oxidanylidene-but-2-enoic acid

Systemtic Name: (E)-4-octan-3-yloxy-4-oxidanylidene-but-2-enoic acid Openeye Name: (E)-4-(1-ethylhexoxy)-4-oxo-but-2-enoic acid CAS Name: (E)-4-octan-3-yloxy-4-oxo-2-butenoic acid IUPAC Name: (E)-4-octan-3-yloxy-4-oxobut-2-enoic acid Traditional Name: (E)-4-(1-ethylhexoxy)-4-keto-but-2-enoic acid Formula: C12H20O4 MolecularWeight: 228.2848

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CC)OC(=O)C=CC(=O)O

Isomeric SMILES

CCCCCC(CC)OC(=O)/C=C/C(=O)O

InChI

InChI=1S/C12H20O4/c1-3-5-6-7-10(4-2)16-12(15)9-8-11(13)14/h8-10H,3-7H2,1-2H3,(H,13,14)/b9-8+