2-tert-butyl-4-ethoxycarbonyl-pyrazole-3-sulfinate

Systemtic Name: 2-tert-butyl-4-ethoxycarbonyl-pyrazole-3-sulfinate Openeye Name: 2-tert-butyl-4-ethoxycarbonyl-pyrazole-3-sulfinate CAS Name: 2-tert-butyl-4-ethoxycarbonyl-3-pyrazolesulfinate IUPAC Name: 2-tert-butyl-4-ethoxycarbonylpyrazole-3-sulfinate Traditional Name: 2-tert-butyl-4-carbethoxy-pyrazole-3-sulfinate Formula: C10H15N2O4S- MolecularWeight: 259.3021

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C(C)(C)C)S(=O)[O-]

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C(C)(C)C)S(=O)[O-]

InChI

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