(E)-4-(3-oxidanylheptan-4-yloxy)-4-oxidanylidene-but-2-enoate

Systemtic Name: (E)-4-(3-oxidanylheptan-4-yloxy)-4-oxidanylidene-but-2-enoate Openeye Name: (E)-4-(2-hydroxy-1-propyl-butoxy)-4-oxo-but-2-enoate CAS Name: (E)-4-(3-hydroxyheptan-4-yloxy)-4-oxo-2-butenoate IUPAC Name: (E)-4-(3-hydroxyheptan-4-yloxy)-4-oxobut-2-enoate Traditional Name: (E)-4-(2-hydroxy-1-propyl-butoxy)-4-keto-but-2-enoate Formula: C11H17O5- MolecularWeight: 229.24968

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(CC)O)OC(=O)C=CC(=O)[O-]

Isomeric SMILES

CCCC(C(CC)O)OC(=O)/C=C/C(=O)[O-]

InChI

InChI=1S/C11H18O5/c1-3-5-9(8(12)4-2)16-11(15)7-6-10(13)14/h6-9,12H,3-5H2,1-2H3,(H,13,14)/p-1/b7-6+