3-[5-(4-chlorophenyl)-1-(4-sulfamoylphenyl)pyrazol-3-yl]propanoic acid

Systemtic Name: 3-[5-(4-chlorophenyl)-1-(4-sulfamoylphenyl)pyrazol-3-yl]propanoic acid Openeye Name: 3-[5-(4-chlorophenyl)-1-(4-sulfamoylphenyl)pyrazol-3-yl]propanoic acid CAS Name: 3-[5-(4-chlorophenyl)-1-(4-sulfamoylphenyl)-3-pyrazolyl]propanoic acid IUPAC Name: 3-[5-(4-chlorophenyl)-1-(4-sulfamoylphenyl)pyrazol-3-yl]propanoic acid Traditional Name: 3-[5-(4-chlorophenyl)-1-(4-sulfamoylphenyl)pyrazol-3-yl]propionic acid Formula: C18H16ClN3O4S MolecularWeight: 405.85534

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=CC(=NN2C3=CC=C(C=C3)S(=O)(=O)N)CCC(=O)O)Cl

Isomeric SMILES

C1=CC(=CC=C1C2=CC(=NN2C3=CC=C(C=C3)S(=O)(=O)N)CCC(=O)O)Cl

InChI

InChI=1S/C18H16ClN3O4S/c19-13-3-1-12(2-4-13)17-11-14(5-10-18(23)24)21-22(17)15-6-8-16(9-7-15)27(20,25)26/h1-4,6-9,11H,5,10H2,(H,23,24)(H2,20,25,26)