4-[3-(hydroxymethyl)-4-methoxy-phenyl]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[3-(hydroxymethyl)-4-methoxy-phenyl]-4-oxidanylidene-butanoic acid Openeye Name: 4-[3-(hydroxymethyl)-4-methoxy-phenyl]-4-oxo-butanoic acid CAS Name: 4-[3-(hydroxymethyl)-4-methoxyphenyl]-4-oxobutanoic acid IUPAC Name: 4-[3-(hydroxymethyl)-4-methoxyphenyl]-4-oxobutanoic acid Traditional Name: 4-keto-4-(4-methoxy-3-methylol-phenyl)butyric acid Formula: C12H14O5 MolecularWeight: 238.23656

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)CCC(=O)O)CO

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)CCC(=O)O)CO

InChI

InChI=1S/C12H14O5/c1-17-11-4-2-8(6-9(11)7-13)10(14)3-5-12(15)16/h2,4,6,13H,3,5,7H2,1H3,(H,15,16)