2-(4-cyanophenoxy)ethyl 3,5-dimethyl-1-[(4-methylphenyl)methyl]pyrazole-4-carboxylate

Systemtic Name: 2-(4-cyanophenoxy)ethyl 3,5-dimethyl-1-[(4-methylphenyl)methyl]pyrazole-4-carboxylate Openeye Name: 2-(4-cyanophenoxy)ethyl 3,5-dimethyl-1-(p-tolylmethyl)pyrazole-4-carboxylate CAS Name: 3,5-dimethyl-1-[(4-methylphenyl)methyl]-4-pyrazolecarboxylic acid 2-(4-cyanophenoxy)ethyl ester IUPAC Name: 2-(4-cyanophenoxy)ethyl 3,5-dimethyl-1-[(4-methylphenyl)methyl]pyrazole-4-carboxylate Traditional Name: 3,5-dimethyl-1-(4-methylbenzyl)pyrazole-4-carboxylic acid 2-(4-cyanophenoxy)ethyl ester Formula: C23H23N3O3 MolecularWeight: 389.44702

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C(=C(C(=N2)C)C(=O)OCCOC3=CC=C(C=C3)C#N)C

Isomeric SMILES

CC1=CC=C(C=C1)CN2C(=C(C(=N2)C)C(=O)OCCOC3=CC=C(C=C3)C#N)C

InChI

InChI=1S/C23H23N3O3/c1-16-4-6-20(7-5-16)15-26-18(3)22(17(2)25-26)23(27)29-13-12-28-21-10-8-19(14-24)9-11-21/h4-11H,12-13,15H2,1-3H3