3-[4-[(4-chloranyl-3-cyano-phenyl)sulfamoyl]phenyl]propanoic acid

Systemtic Name: 3-[4-[(4-chloranyl-3-cyano-phenyl)sulfamoyl]phenyl]propanoic acid Openeye Name: 3-[4-[(4-chloro-3-cyano-phenyl)sulfamoyl]phenyl]propanoic acid CAS Name: 3-[4-[(4-chloro-3-cyanophenyl)sulfamoyl]phenyl]propanoic acid IUPAC Name: 3-[4-[(4-chloro-3-cyanophenyl)sulfamoyl]phenyl]propanoic acid Traditional Name: 3-[4-[(4-chloro-3-cyano-phenyl)sulfamoyl]phenyl]propionic acid Formula: C16H13ClN2O4S MolecularWeight: 364.80342

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCC(=O)O)S(=O)(=O)NC2=CC(=C(C=C2)Cl)C#N

Isomeric SMILES

C1=CC(=CC=C1CCC(=O)O)S(=O)(=O)NC2=CC(=C(C=C2)Cl)C#N

InChI

InChI=1S/C16H13ClN2O4S/c17-15-7-4-13(9-12(15)10-18)19-24(22,23)14-5-1-11(2-6-14)3-8-16(20)21/h1-2,4-7,9,19H,3,8H2,(H,20,21)