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

Systemtic Name: (E)-4-(1-oxidanylhexan-3-yloxy)-4-oxidanylidene-but-2-enoic acid Openeye Name: (E)-4-[1-(2-hydroxyethyl)butoxy]-4-oxo-but-2-enoic acid CAS Name: (E)-4-(1-hydroxyhexan-3-yloxy)-4-oxo-2-butenoic acid IUPAC Name: (E)-4-(1-hydroxyhexan-3-yloxy)-4-oxobut-2-enoic acid Traditional Name: (E)-4-[1-(2-hydroxyethyl)butoxy]-4-keto-but-2-enoic acid Formula: C10H16O5 MolecularWeight: 216.23104

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H16O5/c1-2-3-8(6-7-11)15-10(14)5-4-9(12)13/h4-5,8,11H,2-3,6-7H2,1H3,(H,12,13)/b5-4+