methyl 5-[[2,4-bis(chloranyl)phenoxy]methyl]-1-tert-butyl-pyrazole-4-carboxylate

Systemtic Name: methyl 5-[[2,4-bis(chloranyl)phenoxy]methyl]-1-tert-butyl-pyrazole-4-carboxylate Openeye Name: methyl 1-tert-butyl-5-[(2,4-dichlorophenoxy)methyl]pyrazole-4-carboxylate CAS Name: 1-tert-butyl-5-[(2,4-dichlorophenoxy)methyl]-4-pyrazolecarboxylic acid methyl ester IUPAC Name: methyl 1-tert-butyl-5-[(2,4-dichlorophenoxy)methyl]pyrazole-4-carboxylate Traditional Name: 1-tert-butyl-5-[(2,4-dichlorophenoxy)methyl]pyrazole-4-carboxylic acid methyl ester Formula: C16H18Cl2N2O3 MolecularWeight: 357.23172

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C(=C(C=N1)C(=O)OC)COC2=C(C=C(C=C2)Cl)Cl

Isomeric SMILES

CC(C)(C)N1C(=C(C=N1)C(=O)OC)COC2=C(C=C(C=C2)Cl)Cl

InChI

InChI=1S/C16H18Cl2N2O3/c1-16(2,3)20-13(11(8-19-20)15(21)22-4)9-23-14-6-5-10(17)7-12(14)18/h5-8H,9H2,1-4H3