3-[4-[(2,4,6-trimethylphenyl)sulfamoyl]phenyl]propanoic acid

Systemtic Name: 3-[4-[(2,4,6-trimethylphenyl)sulfamoyl]phenyl]propanoic acid Openeye Name: 3-[4-[(2,4,6-trimethylphenyl)sulfamoyl]phenyl]propanoic acid CAS Name: 3-[4-[(2,4,6-trimethylphenyl)sulfamoyl]phenyl]propanoic acid IUPAC Name: 3-[4-[(2,4,6-trimethylphenyl)sulfamoyl]phenyl]propanoic acid Traditional Name: 3-[4-(mesitylsulfamoyl)phenyl]propionic acid Formula: C18H21NO4S MolecularWeight: 347.42864

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)NS(=O)(=O)C2=CC=C(C=C2)CCC(=O)O)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NS(=O)(=O)C2=CC=C(C=C2)CCC(=O)O)C

InChI

InChI=1S/C18H21NO4S/c1-12-10-13(2)18(14(3)11-12)19-24(22,23)16-7-4-15(5-8-16)6-9-17(20)21/h4-5,7-8,10-11,19H,6,9H2,1-3H3,(H,20,21)