[4-(phenylsulfonyl)phenyl]methyl 5-bromanyl-2-oxidanyl-benzoate

Systemtic Name: [4-(phenylsulfonyl)phenyl]methyl 5-bromanyl-2-oxidanyl-benzoate Openeye Name: [4-(benzenesulfonyl)phenyl]methyl 5-bromo-2-hydroxy-benzoate CAS Name: 5-bromo-2-hydroxybenzoic acid [4-(benzenesulfonyl)phenyl]methyl ester IUPAC Name: [4-(benzenesulfonyl)phenyl]methyl 5-bromo-2-hydroxybenzoate Traditional Name: 5-bromo-2-hydroxy-benzoic acid (4-besylbenzyl) ester Formula: C20H15BrO5S MolecularWeight: 447.2991

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)C2=CC=C(C=C2)COC(=O)C3=C(C=CC(=C3)Br)O

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)C2=CC=C(C=C2)COC(=O)C3=C(C=CC(=C3)Br)O

InChI

InChI=1S/C20H15BrO5S/c21-15-8-11-19(22)18(12-15)20(23)26-13-14-6-9-17(10-7-14)27(24,25)16-4-2-1-3-5-16/h1-12,22H,13H2