(E)-4-(4-ethyl-2,2-dimethyl-octan-3-yl)oxy-4-oxidanylidene-but-2-enoic acid

Systemtic Name: (E)-4-(4-ethyl-2,2-dimethyl-octan-3-yl)oxy-4-oxidanylidene-but-2-enoic acid Openeye Name: (E)-4-(1-tert-butyl-2-ethyl-hexoxy)-4-oxo-but-2-enoic acid CAS Name: (E)-4-(4-ethyl-2,2-dimethyloctan-3-yl)oxy-4-oxo-2-butenoic acid IUPAC Name: (E)-4-(4-ethyl-2,2-dimethyloctan-3-yl)oxy-4-oxobut-2-enoic acid Traditional Name: (E)-4-(1-tert-butyl-2-ethyl-hexoxy)-4-keto-but-2-enoic acid Formula: C16H28O4 MolecularWeight: 284.39112

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C(C(C)(C)C)OC(=O)C=CC(=O)O

Isomeric SMILES

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

InChI

InChI=1S/C16H28O4/c1-6-8-9-12(7-2)15(16(3,4)5)20-14(19)11-10-13(17)18/h10-12,15H,6-9H2,1-5H3,(H,17,18)/b11-10+