methyl 3-(2-bromanyl-4-cyano-6-ethoxy-phenoxy)sulfonyl-4-chloranyl-benzoate

Systemtic Name: methyl 3-(2-bromanyl-4-cyano-6-ethoxy-phenoxy)sulfonyl-4-chloranyl-benzoate Openeye Name: methyl 3-(2-bromo-4-cyano-6-ethoxy-phenoxy)sulfonyl-4-chloro-benzoate CAS Name: 3-(2-bromo-4-cyano-6-ethoxyphenoxy)sulfonyl-4-chlorobenzoic acid methyl ester IUPAC Name: methyl 3-(2-bromo-4-cyano-6-ethoxyphenoxy)sulfonyl-4-chlorobenzoate Traditional Name: 3-(2-bromo-4-cyano-6-ethoxy-phenoxy)sulfonyl-4-chloro-benzoic acid methyl ester Formula: C17H13BrClNO6S MolecularWeight: 474.71022

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C#N)Br)OS(=O)(=O)C2=C(C=CC(=C2)C(=O)OC)Cl

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C#N)Br)OS(=O)(=O)C2=C(C=CC(=C2)C(=O)OC)Cl

InChI

InChI=1S/C17H13BrClNO6S/c1-3-25-14-7-10(9-20)6-12(18)16(14)26-27(22,23)15-8-11(17(21)24-2)4-5-13(15)19/h4-8H,3H2,1-2H3