ethyl 1-tert-butyl-5-methylsulfonyl-pyrazole-4-carboxylate

Systemtic Name: ethyl 1-tert-butyl-5-methylsulfonyl-pyrazole-4-carboxylate Openeye Name: ethyl 1-tert-butyl-5-methylsulfonyl-pyrazole-4-carboxylate CAS Name: 1-tert-butyl-5-methylsulfonyl-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-tert-butyl-5-methylsulfonylpyrazole-4-carboxylate Traditional Name: 1-tert-butyl-5-mesyl-pyrazole-4-carboxylic acid ethyl ester Formula: C11H18N2O4S MolecularWeight: 274.33662

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C(C)(C)C)S(=O)(=O)C

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C(C)(C)C)S(=O)(=O)C

InChI

InChI=1S/C11H18N2O4S/c1-6-17-10(14)8-7-12-13(11(2,3)4)9(8)18(5,15)16/h7H,6H2,1-5H3