3-[2-[3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]ethanoyloxy]-2-phenyl-propanoate

Systemtic Name: 3-[2-[3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]ethanoyloxy]-2-phenyl-propanoate Openeye Name: 3-[2-[3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]acetyl]oxy-2-phenyl-propanoate CAS Name: 3-[2-[3-(4-chlorophenyl)-1-phenyl-4-pyrazolyl]-1-oxoethoxy]-2-phenylpropanoate IUPAC Name: 3-[2-[3-(4-chlorophenyl)-1-phenylpyrazol-4-yl]acetyl]oxy-2-phenylpropanoate Traditional Name: 3-[2-[3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]acetyl]oxy-2-phenyl-propionate Formula: C26H20ClN2O4- MolecularWeight: 459.901

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(COC(=O)CC2=CN(N=C2C3=CC=C(C=C3)Cl)C4=CC=CC=C4)C(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C(COC(=O)CC2=CN(N=C2C3=CC=C(C=C3)Cl)C4=CC=CC=C4)C(=O)[O-]

InChI

InChI=1S/C26H21ClN2O4/c27-21-13-11-19(12-14-21)25-20(16-29(28-25)22-9-5-2-6-10-22)15-24(30)33-17-23(26(31)32)18-7-3-1-4-8-18/h1-14,16,23H,15,17H2,(H,31,32)/p-1