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

Systemtic Name: 3-[4-chloranyl-5-(4-chlorophenyl)-1-(4-sulfamoylphenyl)pyrazol-3-yl]propanoic acid Openeye Name: 3-[4-chloro-5-(4-chlorophenyl)-1-(4-sulfamoylphenyl)pyrazol-3-yl]propanoic acid CAS Name: 3-[4-chloro-5-(4-chlorophenyl)-1-(4-sulfamoylphenyl)-3-pyrazolyl]propanoic acid IUPAC Name: 3-[4-chloro-5-(4-chlorophenyl)-1-(4-sulfamoylphenyl)pyrazol-3-yl]propanoic acid Traditional Name: 3-[4-chloro-5-(4-chlorophenyl)-1-(4-sulfamoylphenyl)pyrazol-3-yl]propionic acid Formula: C18H15Cl2N3O4S MolecularWeight: 440.3004

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H15Cl2N3O4S/c19-12-3-1-11(2-4-12)18-17(20)15(9-10-16(24)25)22-23(18)13-5-7-14(8-6-13)28(21,26)27/h1-8H,9-10H2,(H,24,25)(H2,21,26,27)