4-[4-(hydroxymethyl)-3-methoxy-phenoxy]butanoate

Systemtic Name: 4-[4-(hydroxymethyl)-3-methoxy-phenoxy]butanoate Openeye Name: 4-[4-(hydroxymethyl)-3-methoxy-phenoxy]butanoate CAS Name: 4-[4-(hydroxymethyl)-3-methoxyphenoxy]butanoate IUPAC Name: 4-[4-(hydroxymethyl)-3-methoxyphenoxy]butanoate Traditional Name: 4-(3-methoxy-4-methylol-phenoxy)butyrate Formula: C12H15O5- MolecularWeight: 239.2445

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)OCCCC(=O)[O-])CO

Isomeric SMILES

COC1=C(C=CC(=C1)OCCCC(=O)[O-])CO

InChI

InChI=1S/C12H16O5/c1-16-11-7-10(5-4-9(11)8-13)17-6-2-3-12(14)15/h4-5,7,13H,2-3,6,8H2,1H3,(H,14,15)/p-1