3-(2-methylbutan-2-yloxymethyl)-1-benzothiophene-2-carboxylic acid

Systemtic Name: 3-(2-methylbutan-2-yloxymethyl)-1-benzothiophene-2-carboxylic acid Openeye Name: 3-(1,1-dimethylpropoxymethyl)benzothiophene-2-carboxylic acid CAS Name: 3-(2-methylbutan-2-yloxymethyl)-1-benzothiophene-2-carboxylic acid IUPAC Name: 3-(2-methylbutan-2-yloxymethyl)-1-benzothiophene-2-carboxylic acid Traditional Name: 3-(tert-amyloxymethyl)benzothiophene-2-carboxylic acid Formula: C15H18O3S MolecularWeight: 278.36662

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)OCC1=C(SC2=CC=CC=C21)C(=O)O

Isomeric SMILES

CCC(C)(C)OCC1=C(SC2=CC=CC=C21)C(=O)O

InChI

InChI=1S/C15H18O3S/c1-4-15(2,3)18-9-11-10-7-5-6-8-12(10)19-13(11)14(16)17/h5-8H,4,9H2,1-3H3,(H,16,17)