(4-tert-butyl-2,6-dimethyl-phenyl)methyl 5-chloranyl-1-[(2-chlorophenyl)methyl]-3-methyl-pyrazole-4-carboxylate

Systemtic Name: (4-tert-butyl-2,6-dimethyl-phenyl)methyl 5-chloranyl-1-[(2-chlorophenyl)methyl]-3-methyl-pyrazole-4-carboxylate Openeye Name: (4-tert-butyl-2,6-dimethyl-phenyl)methyl 5-chloro-1-[(2-chlorophenyl)methyl]-3-methyl-pyrazole-4-carboxylate CAS Name: 5-chloro-1-[(2-chlorophenyl)methyl]-3-methyl-4-pyrazolecarboxylic acid (4-tert-butyl-2,6-dimethylphenyl)methyl ester IUPAC Name: (4-tert-butyl-2,6-dimethylphenyl)methyl 5-chloro-1-[(2-chlorophenyl)methyl]-3-methylpyrazole-4-carboxylate Traditional Name: 5-chloro-1-(2-chlorobenzyl)-3-methyl-pyrazole-4-carboxylic acid (4-tert-butyl-2,6-dimethyl-benzyl) ester Formula: C25H28Cl2N2O2 MolecularWeight: 459.40802

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1COC(=O)C2=C(N(N=C2C)CC3=CC=CC=C3Cl)Cl)C)C(C)(C)C

Isomeric SMILES

CC1=CC(=CC(=C1COC(=O)C2=C(N(N=C2C)CC3=CC=CC=C3Cl)Cl)C)C(C)(C)C

InChI

InChI=1S/C25H28Cl2N2O2/c1-15-11-19(25(4,5)6)12-16(2)20(15)14-31-24(30)22-17(3)28-29(23(22)27)13-18-9-7-8-10-21(18)26/h7-12H,13-14H2,1-6H3