4-ethoxycarbonyl-5-methoxy-2-methyl-pyrazole-3-sulfinic acid

Systemtic Name: 4-ethoxycarbonyl-5-methoxy-2-methyl-pyrazole-3-sulfinic acid Openeye Name: 4-ethoxycarbonyl-5-methoxy-2-methyl-pyrazole-3-sulfinic acid CAS Name: 4-ethoxycarbonyl-5-methoxy-2-methyl-3-pyrazolesulfinic acid IUPAC Name: 4-ethoxycarbonyl-5-methoxy-2-methylpyrazole-3-sulfinic acid Traditional Name: 4-carbethoxy-5-methoxy-2-methyl-pyrazole-3-sulfinic acid Formula: C8H12N2O5S MolecularWeight: 248.25628

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1OC)C)S(=O)O

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1OC)C)S(=O)O

InChI

InChI=1S/C8H12N2O5S/c1-4-15-8(11)5-6(14-3)9-10(2)7(5)16(12)13/h4H2,1-3H3,(H,12,13)