(E)-4-[2,2-bis(hydroxymethyl)-3-oxidanyl-propoxy]-4-oxidanylidene-but-2-enoic acid

Systemtic Name: (E)-4-[2,2-bis(hydroxymethyl)-3-oxidanyl-propoxy]-4-oxidanylidene-but-2-enoic acid Openeye Name: (E)-4-[3-hydroxy-2,2-bis(hydroxymethyl)propoxy]-4-oxo-but-2-enoic acid CAS Name: (E)-4-[3-hydroxy-2,2-bis(hydroxymethyl)propoxy]-4-oxo-2-butenoic acid IUPAC Name: (E)-4-[3-hydroxy-2,2-bis(hydroxymethyl)propoxy]-4-oxobut-2-enoic acid Traditional Name: (E)-4-(3-hydroxy-2,2-dimethylol-propoxy)-4-keto-but-2-enoic acid Formula: C9H14O7 MolecularWeight: 234.20326

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Descriptors Computed from Structure

Canonical SMILES:

C(C(CO)(CO)COC(=O)C=CC(=O)O)O

Isomeric SMILES

C(C(CO)(CO)COC(=O)/C=C/C(=O)O)O

InChI

InChI=1S/C9H14O7/c10-3-9(4-11,5-12)6-16-8(15)2-1-7(13)14/h1-2,10-12H,3-6H2,(H,13,14)/b2-1+