5-[(4-bromophenyl)sulfinylmethyl]furan-2-carboxylic acid

Systemtic Name: 5-[(4-bromophenyl)sulfinylmethyl]furan-2-carboxylic acid Openeye Name: 5-[(4-bromophenyl)sulfinylmethyl]furan-2-carboxylic acid CAS Name: 5-[(4-bromophenyl)sulfinylmethyl]-2-furancarboxylic acid IUPAC Name: 5-[(4-bromophenyl)sulfinylmethyl]furan-2-carboxylic acid Traditional Name: 5-[(4-bromophenyl)sulfinylmethyl]-2-furoic acid Formula: C12H9BrO4S MolecularWeight: 329.16646

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1S(=O)CC2=CC=C(O2)C(=O)O)Br

Isomeric SMILES

C1=CC(=CC=C1S(=O)CC2=CC=C(O2)C(=O)O)Br

InChI

InChI=1S/C12H9BrO4S/c13-8-1-4-10(5-2-8)18(16)7-9-3-6-11(17-9)12(14)15/h1-6H,7H2,(H,14,15)