(E)-4-[(3R)-3-oxidanylbutoxy]-4-oxidanylidene-but-2-enoate

Systemtic Name: (E)-4-[(3R)-3-oxidanylbutoxy]-4-oxidanylidene-but-2-enoate Openeye Name: (E)-4-[(3R)-3-hydroxybutoxy]-4-oxo-but-2-enoate CAS Name: (E)-4-[(3R)-3-hydroxybutoxy]-4-oxo-2-butenoate IUPAC Name: (E)-4-[(3R)-3-hydroxybutoxy]-4-oxobut-2-enoate Traditional Name: (E)-4-[(3R)-3-hydroxybutoxy]-4-keto-but-2-enoate Formula: C8H11O5- MolecularWeight: 187.16994

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCOC(=O)C=CC(=O)[O-])O

Isomeric SMILES

C[C@H](CCOC(=O)/C=C/C(=O)[O-])O

InChI

InChI=1S/C8H12O5/c1-6(9)4-5-13-8(12)3-2-7(10)11/h2-3,6,9H,4-5H2,1H3,(H,10,11)/p-1/b3-2+/t6-/m1/s1