4-[3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]butanoic acid

Systemtic Name: 4-[3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]butanoic acid Openeye Name: 4-[3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]butanoic acid CAS Name: 4-[3-(4-chlorophenyl)-1-phenyl-4-pyrazolyl]butanoic acid IUPAC Name: 4-[3-(4-chlorophenyl)-1-phenylpyrazol-4-yl]butanoic acid Traditional Name: 4-[3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]butyric acid Formula: C19H17ClN2O2 MolecularWeight: 340.80348

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC=C(C=C3)Cl)CCCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC=C(C=C3)Cl)CCCC(=O)O

InChI

InChI=1S/C19H17ClN2O2/c20-16-11-9-14(10-12-16)19-15(5-4-8-18(23)24)13-22(21-19)17-6-2-1-3-7-17/h1-3,6-7,9-13H,4-5,8H2,(H,23,24)