3-butoxy-1-benzothiophene-2-carboxylic acid

Systemtic Name: 3-butoxy-1-benzothiophene-2-carboxylic acid Openeye Name: 3-butoxybenzothiophene-2-carboxylic acid CAS Name: 3-butoxy-1-benzothiophene-2-carboxylic acid IUPAC Name: 3-butoxy-1-benzothiophene-2-carboxylic acid Traditional Name: 3-butoxybenzothiophene-2-carboxylic acid Formula: C13H14O3S MolecularWeight: 250.31346

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(SC2=CC=CC=C21)C(=O)O

Isomeric SMILES

CCCCOC1=C(SC2=CC=CC=C21)C(=O)O

InChI

InChI=1S/C13H14O3S/c1-2-3-8-16-11-9-6-4-5-7-10(9)17-12(11)13(14)15/h4-7H,2-3,8H2,1H3,(H,14,15)