3-[4-[(5-methoxycarbonyl-2-methyl-phenyl)sulfamoyl]phenyl]propanoic acid

Systemtic Name: 3-[4-[(5-methoxycarbonyl-2-methyl-phenyl)sulfamoyl]phenyl]propanoic acid Openeye Name: 3-[4-[(5-methoxycarbonyl-2-methyl-phenyl)sulfamoyl]phenyl]propanoic acid CAS Name: 3-[4-[(5-methoxycarbonyl-2-methylphenyl)sulfamoyl]phenyl]propanoic acid IUPAC Name: 3-[4-[(5-methoxycarbonyl-2-methylphenyl)sulfamoyl]phenyl]propanoic acid Traditional Name: 3-[4-[(5-carbomethoxy-2-methyl-phenyl)sulfamoyl]phenyl]propionic acid Formula: C18H19NO6S MolecularWeight: 377.41156

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19NO6S/c1-12-3-7-14(18(22)25-2)11-16(12)19-26(23,24)15-8-4-13(5-9-15)6-10-17(20)21/h3-5,7-9,11,19H,6,10H2,1-2H3,(H,20,21)