ethyl 3-(3,5-dimethyl-1-methylsulfonyl-pyrazol-4-yl)propanoate

Systemtic Name: ethyl 3-(3,5-dimethyl-1-methylsulfonyl-pyrazol-4-yl)propanoate Openeye Name: ethyl 3-(3,5-dimethyl-1-methylsulfonyl-pyrazol-4-yl)propanoate CAS Name: 3-(3,5-dimethyl-1-methylsulfonyl-4-pyrazolyl)propanoic acid ethyl ester IUPAC Name: ethyl 3-(3,5-dimethyl-1-methylsulfonylpyrazol-4-yl)propanoate Traditional Name: 3-(1-mesyl-3,5-dimethyl-pyrazol-4-yl)propionic acid ethyl ester Formula: C11H18N2O4S MolecularWeight: 274.33662

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC1=C(N(N=C1C)S(=O)(=O)C)C

Isomeric SMILES

CCOC(=O)CCC1=C(N(N=C1C)S(=O)(=O)C)C

InChI

InChI=1S/C11H18N2O4S/c1-5-17-11(14)7-6-10-8(2)12-13(9(10)3)18(4,15)16/h5-7H2,1-4H3