(E)-4-oxidanylidene-4-(1-oxidanylpentan-3-yloxy)but-2-enoic acid

Systemtic Name: (E)-4-oxidanylidene-4-(1-oxidanylpentan-3-yloxy)but-2-enoic acid Openeye Name: (E)-4-(1-ethyl-3-hydroxy-propoxy)-4-oxo-but-2-enoic acid CAS Name: (E)-4-(1-hydroxypentan-3-yloxy)-4-oxo-2-butenoic acid IUPAC Name: (E)-4-(1-hydroxypentan-3-yloxy)-4-oxobut-2-enoic acid Traditional Name: (E)-4-(1-ethyl-3-hydroxy-propoxy)-4-keto-but-2-enoic acid Formula: C9H14O5 MolecularWeight: 202.20446

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CCO)OC(=O)C=CC(=O)O

Isomeric SMILES

CCC(CCO)OC(=O)/C=C/C(=O)O

InChI

InChI=1S/C9H14O5/c1-2-7(5-6-10)14-9(13)4-3-8(11)12/h3-4,7,10H,2,5-6H2,1H3,(H,11,12)/b4-3+