2-[4-(2,4-dichlorophenyl)carbonyl-2,5-dimethyl-pyrazol-3-yl]oxy-1-phenyl-ethanone

Systemtic Name: 2-[4-(2,4-dichlorophenyl)carbonyl-2,5-dimethyl-pyrazol-3-yl]oxy-1-phenyl-ethanone Openeye Name: 2-[4-(2,4-dichlorobenzoyl)-2,5-dimethyl-pyrazol-3-yl]oxy-1-phenyl-ethanone CAS Name: 2-[[4-[(2,4-dichlorophenyl)-oxomethyl]-2,5-dimethyl-3-pyrazolyl]oxy]-1-phenylethanone IUPAC Name: 2-[4-(2,4-dichlorobenzoyl)-2,5-dimethylpyrazol-3-yl]oxy-1-phenylethanone Traditional Name: 2-[4-(2,4-dichlorobenzoyl)-2,5-dimethyl-pyrazol-3-yl]oxy-1-phenyl-ethanone Formula: C40H32Cl4N4O6 MolecularWeight: 806.51728

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)C2=C(C=C(C=C2)Cl)Cl)OCC(=O)C3=CC=CC=C3)C.CC1=NN(C(=C1C(=O)C2=C(C=C(C=C2)Cl)Cl)OCC(=O)C3=CC=CC=C3)C

Isomeric SMILES

CC1=NN(C(=C1C(=O)C2=C(C=C(C=C2)Cl)Cl)OCC(=O)C3=CC=CC=C3)C.CC1=NN(C(=C1C(=O)C2=C(C=C(C=C2)Cl)Cl)OCC(=O)C3=CC=CC=C3)C

InChI

InChI=1S/2C20H16Cl2N2O3/c2*1-12-18(19(26)15-9-8-14(21)10-16(15)22)20(24(2)23-12)27-11-17(25)13-6-4-3-5-7-13/h2*3-10H,11H2,1-2H3