1-[5-(4-chlorophenyl)-1-(2,4-dichlorophenyl)-4-methyl-pyrazol-3-yl]hexan-1-one

Systemtic Name: 1-[5-(4-chlorophenyl)-1-(2,4-dichlorophenyl)-4-methyl-pyrazol-3-yl]hexan-1-one Openeye Name: 1-[5-(4-chlorophenyl)-1-(2,4-dichlorophenyl)-4-methyl-pyrazol-3-yl]hexan-1-one CAS Name: 1-[5-(4-chlorophenyl)-1-(2,4-dichlorophenyl)-4-methyl-3-pyrazolyl]-1-hexanone IUPAC Name: 1-[5-(4-chlorophenyl)-1-(2,4-dichlorophenyl)-4-methylpyrazol-3-yl]hexan-1-one Traditional Name: 1-[5-(4-chlorophenyl)-1-(2,4-dichlorophenyl)-4-methyl-pyrazol-3-yl]hexan-1-one Formula: C22H21Cl3N2O MolecularWeight: 435.77394

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)C1=NN(C(=C1C)C2=CC=C(C=C2)Cl)C3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

CCCCCC(=O)C1=NN(C(=C1C)C2=CC=C(C=C2)Cl)C3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C22H21Cl3N2O/c1-3-4-5-6-20(28)21-14(2)22(15-7-9-16(23)10-8-15)27(26-21)19-12-11-17(24)13-18(19)25/h7-13H,3-6H2,1-2H3