3-[4-[[1-(2-chlorophenyl)-3-methoxy-3-oxidanylidene-propyl]sulfamoyl]phenyl]propanoic acid

Systemtic Name: 3-[4-[[1-(2-chlorophenyl)-3-methoxy-3-oxidanylidene-propyl]sulfamoyl]phenyl]propanoic acid Openeye Name: 3-[4-[[1-(2-chlorophenyl)-3-methoxy-3-oxo-propyl]sulfamoyl]phenyl]propanoic acid CAS Name: 3-[4-[[1-(2-chlorophenyl)-3-methoxy-3-oxopropyl]sulfamoyl]phenyl]propanoic acid IUPAC Name: 3-[4-[[1-(2-chlorophenyl)-3-methoxy-3-oxopropyl]sulfamoyl]phenyl]propanoic acid Traditional Name: 3-[4-[[1-(2-chlorophenyl)-3-keto-3-methoxy-propyl]sulfamoyl]phenyl]propionic acid Formula: C19H20ClNO6S MolecularWeight: 425.8832

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(C1=CC=CC=C1Cl)NS(=O)(=O)C2=CC=C(C=C2)CCC(=O)O

Isomeric SMILES

COC(=O)CC(C1=CC=CC=C1Cl)NS(=O)(=O)C2=CC=C(C=C2)CCC(=O)O

InChI

InChI=1S/C19H20ClNO6S/c1-27-19(24)12-17(15-4-2-3-5-16(15)20)21-28(25,26)14-9-6-13(7-10-14)8-11-18(22)23/h2-7,9-10,17,21H,8,11-12H2,1H3,(H,22,23)