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

Systemtic Name: 3-(butoxymethyl)-1-benzothiophene-2-carboxylic acid Openeye Name: 3-(butoxymethyl)benzothiophene-2-carboxylic acid CAS Name: 3-(butoxymethyl)-1-benzothiophene-2-carboxylic acid IUPAC Name: 3-(butoxymethyl)-1-benzothiophene-2-carboxylic acid Traditional Name: 3-(butoxymethyl)benzothiophene-2-carboxylic acid Formula: C14H16O3S MolecularWeight: 264.34004

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOCC1=C(SC2=CC=CC=C21)C(=O)O

Isomeric SMILES

CCCCOCC1=C(SC2=CC=CC=C21)C(=O)O

InChI

InChI=1S/C14H16O3S/c1-2-3-8-17-9-11-10-6-4-5-7-12(10)18-13(11)14(15)16/h4-7H,2-3,8-9H2,1H3,(H,15,16)