7-(3,4-dimethoxyphenyl)-5-(hydroxymethyl)-4-(methoxymethoxy)-1-benzothiophene-6-carboxylic acid

Systemtic Name: 7-(3,4-dimethoxyphenyl)-5-(hydroxymethyl)-4-(methoxymethoxy)-1-benzothiophene-6-carboxylic acid Openeye Name: 7-(3,4-dimethoxyphenyl)-5-(hydroxymethyl)-4-(methoxymethoxy)benzothiophene-6-carboxylic acid CAS Name: 7-(3,4-dimethoxyphenyl)-5-(hydroxymethyl)-4-(methoxymethoxy)-1-benzothiophene-6-carboxylic acid IUPAC Name: 7-(3,4-dimethoxyphenyl)-5-(hydroxymethyl)-4-(methoxymethoxy)-1-benzothiophene-6-carboxylic acid Traditional Name: 7-(3,4-dimethoxyphenyl)-4-(methoxymethoxy)-5-methylol-benzothiophene-6-carboxylic acid Formula: C20H20O7S MolecularWeight: 404.4336

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Descriptors Computed from Structure

Canonical SMILES:

COCOC1=C2C=CSC2=C(C(=C1CO)C(=O)O)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

COCOC1=C2C=CSC2=C(C(=C1CO)C(=O)O)C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C20H20O7S/c1-24-10-27-18-12-6-7-28-19(12)16(17(20(22)23)13(18)9-21)11-4-5-14(25-2)15(8-11)26-3/h4-8,21H,9-10H2,1-3H3,(H,22,23)