(phenylmethyl) 3-bromanyl-5-methoxy-4-(4-methylphenyl)sulfonyloxy-benzoate

Systemtic Name: (phenylmethyl) 3-bromanyl-5-methoxy-4-(4-methylphenyl)sulfonyloxy-benzoate Openeye Name: benzyl 3-bromo-5-methoxy-4-(p-tolylsulfonyloxy)benzoate CAS Name: 3-bromo-5-methoxy-4-(4-methylphenyl)sulfonyloxybenzoic acid (phenylmethyl) ester IUPAC Name: benzyl 3-bromo-5-methoxy-4-(4-methylphenyl)sulfonyloxybenzoate Traditional Name: 3-bromo-5-methoxy-4-tosyloxy-benzoic acid benzyl ester Formula: C22H19BrO6S MolecularWeight: 491.35166

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=C(C=C(C=C2Br)C(=O)OCC3=CC=CC=C3)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=C(C=C(C=C2Br)C(=O)OCC3=CC=CC=C3)OC

InChI

InChI=1S/C22H19BrO6S/c1-15-8-10-18(11-9-15)30(25,26)29-21-19(23)12-17(13-20(21)27-2)22(24)28-14-16-6-4-3-5-7-16/h3-13H,14H2,1-2H3