methyl 3-butoxy-4,5-bis(oxidanyl)benzoate

Systemtic Name: methyl 3-butoxy-4,5-bis(oxidanyl)benzoate Openeye Name: methyl 3-butoxy-4,5-dihydroxy-benzoate CAS Name: 3-butoxy-4,5-dihydroxybenzoic acid methyl ester IUPAC Name: methyl 3-butoxy-4,5-dihydroxybenzoate Traditional Name: 3-butoxy-4,5-dihydroxy-benzoic acid methyl ester Formula: C12H16O5 MolecularWeight: 240.25244

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC(=CC(=C1O)O)C(=O)OC

Isomeric SMILES

CCCCOC1=CC(=CC(=C1O)O)C(=O)OC

InChI

InChI=1S/C12H16O5/c1-3-4-5-17-10-7-8(12(15)16-2)6-9(13)11(10)14/h6-7,13-14H,3-5H2,1-2H3