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

Systemtic Name: 3-(phenoxymethyl)-1-benzothiophene-2-carboxylic acid Openeye Name: 3-(phenoxymethyl)benzothiophene-2-carboxylic acid CAS Name: 3-(phenoxymethyl)-1-benzothiophene-2-carboxylic acid IUPAC Name: 3-(phenoxymethyl)-1-benzothiophene-2-carboxylic acid Traditional Name: 3-(phenoxymethyl)benzothiophene-2-carboxylic acid Formula: C16H12O3S MolecularWeight: 284.32968

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCC2=C(SC3=CC=CC=C32)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)OCC2=C(SC3=CC=CC=C32)C(=O)O

InChI

InChI=1S/C16H12O3S/c17-16(18)15-13(10-19-11-6-2-1-3-7-11)12-8-4-5-9-14(12)20-15/h1-9H,10H2,(H,17,18)