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

Systemtic Name: 3-(hexoxymethyl)-1-benzothiophene-2-carboxylic acid Openeye Name: 3-(hexoxymethyl)benzothiophene-2-carboxylic acid CAS Name: 3-(hexoxymethyl)-1-benzothiophene-2-carboxylic acid IUPAC Name: 3-(hexoxymethyl)-1-benzothiophene-2-carboxylic acid Traditional Name: 3-(hexoxymethyl)benzothiophene-2-carboxylic acid Formula: C16H20O3S MolecularWeight: 292.3932

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H20O3S/c1-2-3-4-7-10-19-11-13-12-8-5-6-9-14(12)20-15(13)16(17)18/h5-6,8-9H,2-4,7,10-11H2,1H3,(H,17,18)