4-(2-ethylhexoxy)-2-methylidene-4-oxidanylidene-butanoic acid

Systemtic Name: 4-(2-ethylhexoxy)-2-methylidene-4-oxidanylidene-butanoic acid Openeye Name: 4-(2-ethylhexoxy)-2-methylene-4-oxo-butanoic acid CAS Name: 4-(2-ethylhexoxy)-2-methylene-4-oxobutanoic acid IUPAC Name: 4-(2-ethylhexoxy)-2-methylidene-4-oxobutanoic acid Traditional Name: 2-[2-(2-ethylhexoxy)-2-keto-ethyl]acrylic acid Formula: C13H22O4 MolecularWeight: 242.31138

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)COC(=O)CC(=C)C(=O)O

Isomeric SMILES

CCCCC(CC)COC(=O)CC(=C)C(=O)O

InChI

InChI=1S/C13H22O4/c1-4-6-7-11(5-2)9-17-12(14)8-10(3)13(15)16/h11H,3-9H2,1-2H3,(H,15,16)