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

Systemtic Name: 5-bromanyl-4-ethoxycarbonyl-2-methyl-pyrazole-3-sulfinic acid Openeye Name: 5-bromo-4-ethoxycarbonyl-2-methyl-pyrazole-3-sulfinic acid CAS Name: 5-bromo-4-ethoxycarbonyl-2-methyl-3-pyrazolesulfinic acid IUPAC Name: 5-bromo-4-ethoxycarbonyl-2-methylpyrazole-3-sulfinic acid Traditional Name: 5-bromo-4-carbethoxy-2-methyl-pyrazole-3-sulfinic acid Formula: C7H9BrN2O4S MolecularWeight: 297.12636

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1Br)C)S(=O)O

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1Br)C)S(=O)O

InChI

InChI=1S/C7H9BrN2O4S/c1-3-14-7(11)4-5(8)9-10(2)6(4)15(12)13/h3H2,1-2H3,(H,12,13)