1,3-benzodioxol-5-ylmethyl 4-fluoranyl-3-(methoxymethyl)-1-benzothiophene-2-carboxylate

Systemtic Name: 1,3-benzodioxol-5-ylmethyl 4-fluoranyl-3-(methoxymethyl)-1-benzothiophene-2-carboxylate Openeye Name: 1,3-benzodioxol-5-ylmethyl 4-fluoro-3-(methoxymethyl)benzothiophene-2-carboxylate CAS Name: 4-fluoro-3-(methoxymethyl)-1-benzothiophene-2-carboxylic acid 1,3-benzodioxol-5-ylmethyl ester IUPAC Name: 1,3-benzodioxol-5-ylmethyl 4-fluoro-3-(methoxymethyl)-1-benzothiophene-2-carboxylate Traditional Name: 4-fluoro-3-(methoxymethyl)benzothiophene-2-carboxylic acid piperonyl ester Formula: C19H15FO5S MolecularWeight: 374.382803

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Descriptors Computed from Structure

Canonical SMILES:

COCC1=C(SC2=CC=CC(=C21)F)C(=O)OCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

COCC1=C(SC2=CC=CC(=C21)F)C(=O)OCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C19H15FO5S/c1-22-9-12-17-13(20)3-2-4-16(17)26-18(12)19(21)23-8-11-5-6-14-15(7-11)25-10-24-14/h2-7H,8-10H2,1H3