3-[(2-ethyl-5-methyl-pyrazol-3-yl)methylsulfonyl]propanoic acid

Systemtic Name: 3-[(2-ethyl-5-methyl-pyrazol-3-yl)methylsulfonyl]propanoic acid Openeye Name: 3-[(2-ethyl-5-methyl-pyrazol-3-yl)methylsulfonyl]propanoic acid CAS Name: 3-[(2-ethyl-5-methyl-3-pyrazolyl)methylsulfonyl]propanoic acid IUPAC Name: 3-[(2-ethyl-5-methylpyrazol-3-yl)methylsulfonyl]propanoic acid Traditional Name: 3-[(2-ethyl-5-methyl-pyrazol-3-yl)methylsulfonyl]propionic acid Formula: C10H16N2O4S MolecularWeight: 260.31004

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC(=N1)C)CS(=O)(=O)CCC(=O)O

Isomeric SMILES

CCN1C(=CC(=N1)C)CS(=O)(=O)CCC(=O)O

InChI

InChI=1S/C10H16N2O4S/c1-3-12-9(6-8(2)11-12)7-17(15,16)5-4-10(13)14/h6H,3-5,7H2,1-2H3,(H,13,14)