[2-(3,4-dichlorophenyl)-5-(methoxymethyl)pyrazol-3-yl] 4-tert-butylbenzoate

Systemtic Name: [2-(3,4-dichlorophenyl)-5-(methoxymethyl)pyrazol-3-yl] 4-tert-butylbenzoate Openeye Name: [2-(3,4-dichlorophenyl)-5-(methoxymethyl)pyrazol-3-yl] 4-tert-butylbenzoate CAS Name: 4-tert-butylbenzoic acid [2-(3,4-dichlorophenyl)-5-(methoxymethyl)-3-pyrazolyl] ester IUPAC Name: [2-(3,4-dichlorophenyl)-5-(methoxymethyl)pyrazol-3-yl] 4-tert-butylbenzoate Traditional Name: 4-tert-butylbenzoic acid [2-(3,4-dichlorophenyl)-5-(methoxymethyl)pyrazol-3-yl] ester Formula: C22H22Cl2N2O3 MolecularWeight: 433.32768

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)OC2=CC(=NN2C3=CC(=C(C=C3)Cl)Cl)COC

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)OC2=CC(=NN2C3=CC(=C(C=C3)Cl)Cl)COC

InChI

InChI=1S/C22H22Cl2N2O3/c1-22(2,3)15-7-5-14(6-8-15)21(27)29-20-11-16(13-28-4)25-26(20)17-9-10-18(23)19(24)12-17/h5-12H,13H2,1-4H3