3-(4-chlorophenyl)-2-(2,4-dichlorophenyl)-4,4-dimethyl-3H-pyrazole-5-carboxylic acid

Systemtic Name: 3-(4-chlorophenyl)-2-(2,4-dichlorophenyl)-4,4-dimethyl-3H-pyrazole-5-carboxylic acid Openeye Name: 3-(4-chlorophenyl)-2-(2,4-dichlorophenyl)-4,4-dimethyl-3H-pyrazole-5-carboxylic acid CAS Name: 3-(4-chlorophenyl)-2-(2,4-dichlorophenyl)-4,4-dimethyl-3H-pyrazole-5-carboxylic acid IUPAC Name: 3-(4-chlorophenyl)-2-(2,4-dichlorophenyl)-4,4-dimethyl-3H-pyrazole-5-carboxylic acid Traditional Name: 5-(4-chlorophenyl)-1-(2,4-dichlorophenyl)-4,4-dimethyl-2-pyrazoline-3-carboxylic acid Formula: C18H15Cl3N2O2 MolecularWeight: 397.6829

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(N(N=C1C(=O)O)C2=C(C=C(C=C2)Cl)Cl)C3=CC=C(C=C3)Cl)C

Isomeric SMILES

CC1(C(N(N=C1C(=O)O)C2=C(C=C(C=C2)Cl)Cl)C3=CC=C(C=C3)Cl)C

InChI

InChI=1S/C18H15Cl3N2O2/c1-18(2)15(17(24)25)22-23(14-8-7-12(20)9-13(14)21)16(18)10-3-5-11(19)6-4-10/h3-9,16H,1-2H3,(H,24,25)