3-[4-[2-(2-chloranylphenoxy)ethyl-methyl-sulfamoyl]phenyl]propanoic acid

Systemtic Name: 3-[4-[2-(2-chloranylphenoxy)ethyl-methyl-sulfamoyl]phenyl]propanoic acid Openeye Name: 3-[4-[2-(2-chlorophenoxy)ethyl-methyl-sulfamoyl]phenyl]propanoic acid CAS Name: 3-[4-[2-(2-chlorophenoxy)ethyl-methylsulfamoyl]phenyl]propanoic acid IUPAC Name: 3-[4-[2-(2-chlorophenoxy)ethyl-methylsulfamoyl]phenyl]propanoic acid Traditional Name: 3-[4-[2-(2-chlorophenoxy)ethyl-methyl-sulfamoyl]phenyl]propionic acid Formula: C18H20ClNO5S MolecularWeight: 397.8731

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCOC1=CC=CC=C1Cl)S(=O)(=O)C2=CC=C(C=C2)CCC(=O)O

Isomeric SMILES

CN(CCOC1=CC=CC=C1Cl)S(=O)(=O)C2=CC=C(C=C2)CCC(=O)O

InChI

InChI=1S/C18H20ClNO5S/c1-20(12-13-25-17-5-3-2-4-16(17)19)26(23,24)15-9-6-14(7-10-15)8-11-18(21)22/h2-7,9-10H,8,11-13H2,1H3,(H,21,22)