3-[(4-iodanylphenoxy)methyl]-1-benzothiophene-2-carboxylic acid

Systemtic Name: 3-[(4-iodanylphenoxy)methyl]-1-benzothiophene-2-carboxylic acid Openeye Name: 3-[(4-iodophenoxy)methyl]benzothiophene-2-carboxylic acid CAS Name: 3-[(4-iodophenoxy)methyl]-1-benzothiophene-2-carboxylic acid IUPAC Name: 3-[(4-iodophenoxy)methyl]-1-benzothiophene-2-carboxylic acid Traditional Name: 3-[(4-iodophenoxy)methyl]benzothiophene-2-carboxylic acid Formula: C16H11IO3S MolecularWeight: 410.22621

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C(S2)C(=O)O)COC3=CC=C(C=C3)I

Isomeric SMILES

C1=CC=C2C(=C1)C(=C(S2)C(=O)O)COC3=CC=C(C=C3)I

InChI

InChI=1S/C16H11IO3S/c17-10-5-7-11(8-6-10)20-9-13-12-3-1-2-4-14(12)21-15(13)16(18)19/h1-8H,9H2,(H,18,19)