5-ethoxy-3-methyl-1-phenyl-pyrazole-4-sulfonic acid

Systemtic Name: 5-ethoxy-3-methyl-1-phenyl-pyrazole-4-sulfonic acid Openeye Name: 5-ethoxy-3-methyl-1-phenyl-pyrazole-4-sulfonic acid CAS Name: 5-ethoxy-3-methyl-1-phenyl-4-pyrazolesulfonic acid IUPAC Name: 5-ethoxy-3-methyl-1-phenylpyrazole-4-sulfonic acid Traditional Name: 5-ethoxy-3-methyl-1-phenyl-pyrazole-4-sulfonic acid Formula: C12H14N2O4S MolecularWeight: 282.31556

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=NN1C2=CC=CC=C2)C)S(=O)(=O)O

Isomeric SMILES

CCOC1=C(C(=NN1C2=CC=CC=C2)C)S(=O)(=O)O

InChI

InChI=1S/C12H14N2O4S/c1-3-18-12-11(19(15,16)17)9(2)13-14(12)10-7-5-4-6-8-10/h4-8H,3H2,1-2H3,(H,15,16,17)