3-(prop-2-enoxymethyl)-1-benzothiophene-2-carboxylic acid

Systemtic Name: 3-(prop-2-enoxymethyl)-1-benzothiophene-2-carboxylic acid Openeye Name: 3-(allyloxymethyl)benzothiophene-2-carboxylic acid CAS Name: 3-(prop-2-enoxymethyl)-1-benzothiophene-2-carboxylic acid IUPAC Name: 3-(prop-2-enoxymethyl)-1-benzothiophene-2-carboxylic acid Traditional Name: 3-(allyloxymethyl)benzothiophene-2-carboxylic acid Formula: C13H12O3S MolecularWeight: 248.29758

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Descriptors Computed from Structure

Canonical SMILES:

C=CCOCC1=C(SC2=CC=CC=C21)C(=O)O

Isomeric SMILES

C=CCOCC1=C(SC2=CC=CC=C21)C(=O)O

InChI

InChI=1S/C13H12O3S/c1-2-7-16-8-10-9-5-3-4-6-11(9)17-12(10)13(14)15/h2-6H,1,7-8H2,(H,14,15)