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

Systemtic Name: 3-[(2-bromanylphenoxy)methyl]-1-benzothiophene-2-carboxylic acid Openeye Name: 3-[(2-bromophenoxy)methyl]benzothiophene-2-carboxylic acid CAS Name: 3-[(2-bromophenoxy)methyl]-1-benzothiophene-2-carboxylic acid IUPAC Name: 3-[(2-bromophenoxy)methyl]-1-benzothiophene-2-carboxylic acid Traditional Name: 3-[(2-bromophenoxy)methyl]benzothiophene-2-carboxylic acid Formula: C16H11BrO3S MolecularWeight: 363.22574

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C(S2)C(=O)O)COC3=CC=CC=C3Br

Isomeric SMILES

C1=CC=C2C(=C1)C(=C(S2)C(=O)O)COC3=CC=CC=C3Br

InChI

InChI=1S/C16H11BrO3S/c17-12-6-2-3-7-13(12)20-9-11-10-5-1-4-8-14(10)21-15(11)16(18)19/h1-8H,9H2,(H,18,19)