methyl 3-bromanylbenzoate; sulfurochloridic acid

Systemtic Name: methyl 3-bromanylbenzoate; sulfurochloridic acid Openeye Name: methyl 3-bromobenzoate; sulfurochloridic acid CAS Name: 3-bromobenzoic acid methyl ester; sulfurochloridic acid IUPAC Name: methyl 3-bromobenzoate; sulfurochloridic acid Traditional Name: 3-bromobenzoic acid methyl ester; sulfurochloridic acid Formula: C8H8BrClO5S MolecularWeight: 331.56812

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)Br.OS(=O)(=O)Cl

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)Br.OS(=O)(=O)Cl

InChI

InChI=1S/C8H7BrO2.ClHO3S/c1-11-8(10)6-3-2-4-7(9)5-6;1-5(2,3)4/h2-5H,1H3;(H,2,3,4)