2-[4-(5-azanyl-3-methoxy-pyrazol-1-yl)phenyl]sulfonylethoxy hydrogen sulfate

Systemtic Name: 2-[4-(5-azanyl-3-methoxy-pyrazol-1-yl)phenyl]sulfonylethoxy hydrogen sulfate Openeye Name: 2-[4-(5-amino-3-methoxy-pyrazol-1-yl)phenyl]sulfonylethoxy hydrogen sulfate CAS Name: sulfuric acid 2-[4-(5-amino-3-methoxy-1-pyrazolyl)phenyl]sulfonylethoxy ester IUPAC Name: 2-[4-(5-amino-3-methoxypyrazol-1-yl)phenyl]sulfonylethoxy hydrogen sulfate Traditional Name: sulfuric acid 2-[4-(5-amino-3-methoxy-pyrazol-1-yl)phenyl]sulfonylethoxy ester Formula: C12H15N3O8S2 MolecularWeight: 393.3928

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NN(C(=C1)N)C2=CC=C(C=C2)S(=O)(=O)CCOOS(=O)(=O)O

Isomeric SMILES

COC1=NN(C(=C1)N)C2=CC=C(C=C2)S(=O)(=O)CCOOS(=O)(=O)O

InChI

InChI=1S/C12H15N3O8S2/c1-21-12-8-11(13)15(14-12)9-2-4-10(5-3-9)24(16,17)7-6-22-23-25(18,19)20/h2-5,8H,6-7,13H2,1H3,(H,18,19,20)