dimethyl 5-[[4-chloranyl-3-(trifluoromethyl)phenyl]sulfamoyl]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[[4-chloranyl-3-(trifluoromethyl)phenyl]sulfamoyl]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[[4-chloro-3-(trifluoromethyl)phenyl]sulfamoyl]benzene-1,3-dicarboxylate CAS Name: 5-[[4-chloro-3-(trifluoromethyl)phenyl]sulfamoyl]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[[4-chloro-3-(trifluoromethyl)phenyl]sulfamoyl]benzene-1,3-dicarboxylate Traditional Name: 5-[[4-chloro-3-(trifluoromethyl)phenyl]sulfamoyl]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C17H13ClF3NO6S MolecularWeight: 451.80143

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)S(=O)(=O)NC2=CC(=C(C=C2)Cl)C(F)(F)F)C(=O)OC

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)S(=O)(=O)NC2=CC(=C(C=C2)Cl)C(F)(F)F)C(=O)OC

InChI

InChI=1S/C17H13ClF3NO6S/c1-27-15(23)9-5-10(16(24)28-2)7-12(6-9)29(25,26)22-11-3-4-14(18)13(8-11)17(19,20)21/h3-8,22H,1-2H3