2-[1-(4-chlorophenyl)-4-phenyl-pyrazol-3-yl]ethanoic acid

Systemtic Name: 2-[1-(4-chlorophenyl)-4-phenyl-pyrazol-3-yl]ethanoic acid Openeye Name: 2-[1-(4-chlorophenyl)-4-phenyl-pyrazol-3-yl]acetic acid CAS Name: 2-[1-(4-chlorophenyl)-4-phenyl-3-pyrazolyl]acetic acid IUPAC Name: 2-[1-(4-chlorophenyl)-4-phenylpyrazol-3-yl]acetic acid Traditional Name: 2-[1-(4-chlorophenyl)-4-phenyl-pyrazol-3-yl]acetic acid Formula: C17H13ClN2O2 MolecularWeight: 312.75032

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CN(N=C2CC(=O)O)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC=C(C=C1)C2=CN(N=C2CC(=O)O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C17H13ClN2O2/c18-13-6-8-14(9-7-13)20-11-15(12-4-2-1-3-5-12)16(19-20)10-17(21)22/h1-9,11H,10H2,(H,21,22)