methyl 1-tert-butyl-5-(4-chlorophenyl)carbonyloxy-pyrazole-3-carboxylate

Systemtic Name: methyl 1-tert-butyl-5-(4-chlorophenyl)carbonyloxy-pyrazole-3-carboxylate Openeye Name: methyl 1-tert-butyl-5-(4-chlorobenzoyl)oxy-pyrazole-3-carboxylate CAS Name: 1-tert-butyl-5-[(4-chlorophenyl)-oxomethoxy]-3-pyrazolecarboxylic acid methyl ester IUPAC Name: methyl 1-tert-butyl-5-(4-chlorobenzoyl)oxypyrazole-3-carboxylate Traditional Name: 1-tert-butyl-5-(4-chlorobenzoyl)oxy-pyrazole-3-carboxylic acid methyl ester Formula: C16H17ClN2O4 MolecularWeight: 336.77018

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H17ClN2O4/c1-16(2,3)19-13(9-12(18-19)15(21)22-4)23-14(20)10-5-7-11(17)8-6-10/h5-9H,1-4H3