(4-bromanylpyridin-3-yl)methyl benzenesulfonate

Systemtic Name: (4-bromanylpyridin-3-yl)methyl benzenesulfonate Openeye Name: (4-bromo-3-pyridyl)methyl benzenesulfonate CAS Name: benzenesulfonic acid (4-bromo-3-pyridinyl)methyl ester IUPAC Name: (4-bromopyridin-3-yl)methyl benzenesulfonate Traditional Name: benzenesulfonic acid (4-bromo-3-pyridyl)methyl ester Formula: C12H10BrNO3S MolecularWeight: 328.1817

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)OCC2=C(C=CN=C2)Br

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)OCC2=C(C=CN=C2)Br

InChI

InChI=1S/C12H10BrNO3S/c13-12-6-7-14-8-10(12)9-17-18(15,16)11-4-2-1-3-5-11/h1-8H,9H2