(E)-3-(hydroxymethyl)-4-methoxy-4-oxidanylidene-but-2-enoic acid

Systemtic Name: (E)-3-(hydroxymethyl)-4-methoxy-4-oxidanylidene-but-2-enoic acid Openeye Name: (E)-3-(hydroxymethyl)-4-methoxy-4-oxo-but-2-enoic acid CAS Name: (E)-3-(hydroxymethyl)-4-methoxy-4-oxo-2-butenoic acid IUPAC Name: (E)-3-(hydroxymethyl)-4-methoxy-4-oxobut-2-enoic acid Traditional Name: (E)-4-keto-4-methoxy-3-methylol-but-2-enoic acid Formula: C6H8O5 MolecularWeight: 160.12472

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C6H8O5/c1-11-6(10)4(3-7)2-5(8)9/h2,7H,3H2,1H3,(H,8,9)/b4-2+