2-(2,6-dimethylphenoxy)ethyl 5-chloranyl-3-methyl-1-[(4-methylphenyl)methyl]pyrazole-4-carboxylate

Systemtic Name: 2-(2,6-dimethylphenoxy)ethyl 5-chloranyl-3-methyl-1-[(4-methylphenyl)methyl]pyrazole-4-carboxylate Openeye Name: 2-(2,6-dimethylphenoxy)ethyl 5-chloro-3-methyl-1-(p-tolylmethyl)pyrazole-4-carboxylate CAS Name: 5-chloro-3-methyl-1-[(4-methylphenyl)methyl]-4-pyrazolecarboxylic acid 2-(2,6-dimethylphenoxy)ethyl ester IUPAC Name: 2-(2,6-dimethylphenoxy)ethyl 5-chloro-3-methyl-1-[(4-methylphenyl)methyl]pyrazole-4-carboxylate Traditional Name: 5-chloro-3-methyl-1-(4-methylbenzyl)pyrazole-4-carboxylic acid 2-(2,6-dimethylphenoxy)ethyl ester Formula: C23H25ClN2O3 MolecularWeight: 412.9092

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C(=C(C(=N2)C)C(=O)OCCOC3=C(C=CC=C3C)C)Cl

Isomeric SMILES

CC1=CC=C(C=C1)CN2C(=C(C(=N2)C)C(=O)OCCOC3=C(C=CC=C3C)C)Cl

InChI

InChI=1S/C23H25ClN2O3/c1-15-8-10-19(11-9-15)14-26-22(24)20(18(4)25-26)23(27)29-13-12-28-21-16(2)6-5-7-17(21)3/h5-11H,12-14H2,1-4H3