(2-bromanyl-4-methanoyl-6-methoxy-phenyl) 3-aminocarbonyl-4-methyl-benzenesulfonate

Systemtic Name: (2-bromanyl-4-methanoyl-6-methoxy-phenyl) 3-aminocarbonyl-4-methyl-benzenesulfonate Openeye Name: (2-bromo-4-formyl-6-methoxy-phenyl) 3-carbamoyl-4-methyl-benzenesulfonate CAS Name: 3-carbamoyl-4-methylbenzenesulfonic acid (2-bromo-4-formyl-6-methoxyphenyl) ester IUPAC Name: (2-bromo-4-formyl-6-methoxyphenyl) 3-carbamoyl-4-methylbenzenesulfonate Traditional Name: 3-carbamoyl-4-methyl-benzenesulfonic acid (2-bromo-4-formyl-6-methoxy-phenyl) ester Formula: C16H14BrNO6S MolecularWeight: 428.25446

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)OC2=C(C=C(C=C2Br)C=O)OC)C(=O)N

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)OC2=C(C=C(C=C2Br)C=O)OC)C(=O)N

InChI

InChI=1S/C16H14BrNO6S/c1-9-3-4-11(7-12(9)16(18)20)25(21,22)24-15-13(17)5-10(8-19)6-14(15)23-2/h3-8H,1-2H3,(H2,18,20)