4-fluoranyl-3-(hexoxymethyl)-1-benzothiophene-2-carboxylic acid

Systemtic Name: 4-fluoranyl-3-(hexoxymethyl)-1-benzothiophene-2-carboxylic acid Openeye Name: 4-fluoro-3-(hexoxymethyl)benzothiophene-2-carboxylic acid CAS Name: 4-fluoro-3-(hexoxymethyl)-1-benzothiophene-2-carboxylic acid IUPAC Name: 4-fluoro-3-(hexoxymethyl)-1-benzothiophene-2-carboxylic acid Traditional Name: 4-fluoro-3-(hexoxymethyl)benzothiophene-2-carboxylic acid Formula: C16H19FO3S MolecularWeight: 310.383663

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOCC1=C(SC2=CC=CC(=C21)F)C(=O)O

Isomeric SMILES

CCCCCCOCC1=C(SC2=CC=CC(=C21)F)C(=O)O

InChI

InChI=1S/C16H19FO3S/c1-2-3-4-5-9-20-10-11-14-12(17)7-6-8-13(14)21-15(11)16(18)19/h6-8H,2-5,9-10H2,1H3,(H,18,19)