methyl 2-[6-(hydroxymethyl)-1,3-benzodioxol-5-yl]-3,4,5-trimethoxy-benzoate

Systemtic Name: methyl 2-[6-(hydroxymethyl)-1,3-benzodioxol-5-yl]-3,4,5-trimethoxy-benzoate Openeye Name: methyl 2-[6-(hydroxymethyl)-1,3-benzodioxol-5-yl]-3,4,5-trimethoxy-benzoate CAS Name: 2-[6-(hydroxymethyl)-1,3-benzodioxol-5-yl]-3,4,5-trimethoxybenzoic acid methyl ester IUPAC Name: methyl 2-[6-(hydroxymethyl)-1,3-benzodioxol-5-yl]-3,4,5-trimethoxybenzoate Traditional Name: 3,4,5-trimethoxy-2-(6-methylol-1,3-benzodioxol-5-yl)benzoic acid methyl ester Formula: C19H20O8 MolecularWeight: 376.3573

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C(=C1)C(=O)OC)C2=CC3=C(C=C2CO)OCO3)OC)OC

Isomeric SMILES

COC1=C(C(=C(C(=C1)C(=O)OC)C2=CC3=C(C=C2CO)OCO3)OC)OC

InChI

InChI=1S/C19H20O8/c1-22-15-7-12(19(21)25-4)16(18(24-3)17(15)23-2)11-6-14-13(26-9-27-14)5-10(11)8-20/h5-7,20H,8-9H2,1-4H3