4-bromanyl-2-methoxy-benzoic acid; [methyl(sulfino)amino]methane

Systemtic Name: 4-bromanyl-2-methoxy-benzoic acid; [methyl(sulfino)amino]methane Openeye Name: 4-bromo-2-methoxy-benzoic acid; [methyl(sulfino)amino]methane CAS Name: 4-bromo-2-methoxybenzoic acid; [methyl(sulfino)amino]methane IUPAC Name: 4-bromo-2-methoxybenzoic acid; [methyl(sulfino)amino]methane Traditional Name: 4-bromo-2-methoxy-benzoic acid; [methyl(sulfino)amino]methane Formula: C10H14BrNO5S MolecularWeight: 340.19086

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)O.COC1=C(C=CC(=C1)Br)C(=O)O

Isomeric SMILES

CN(C)S(=O)O.COC1=C(C=CC(=C1)Br)C(=O)O

InChI

InChI=1S/C8H7BrO3.C2H7NO2S/c1-12-7-4-5(9)2-3-6(7)8(10)11;1-3(2)6(4)5/h2-4H,1H3,(H,10,11);1-2H3,(H,4,5)