2-[1-(4-chlorophenyl)-5-pyrrol-1-yl-pyrazol-4-yl]ethanoic acid

Systemtic Name: 2-[1-(4-chlorophenyl)-5-pyrrol-1-yl-pyrazol-4-yl]ethanoic acid Openeye Name: 2-[1-(4-chlorophenyl)-5-pyrrol-1-yl-pyrazol-4-yl]acetic acid CAS Name: 2-[1-(4-chlorophenyl)-5-(1-pyrrolyl)-4-pyrazolyl]acetic acid IUPAC Name: 2-[1-(4-chlorophenyl)-5-pyrrol-1-ylpyrazol-4-yl]acetic acid Traditional Name: 2-[1-(4-chlorophenyl)-5-pyrrol-1-yl-pyrazol-4-yl]acetic acid Formula: C15H12ClN3O2 MolecularWeight: 301.72768

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CN(C=C1)C2=C(C=NN2C3=CC=C(C=C3)Cl)CC(=O)O

Isomeric SMILES

C1=CN(C=C1)C2=C(C=NN2C3=CC=C(C=C3)Cl)CC(=O)O

InChI

InChI=1S/C15H12ClN3O2/c16-12-3-5-13(6-4-12)19-15(18-7-1-2-8-18)11(10-17-19)9-14(20)21/h1-8,10H,9H2,(H,20,21)