(4-oxidanylidene-2-pyrazol-1-yl-chromen-6-yl) thiohypochlorite

Systemtic Name: (4-oxidanylidene-2-pyrazol-1-yl-chromen-6-yl) thiohypochlorite Openeye Name: (4-oxo-2-pyrazol-1-yl-chromen-6-yl) thiohypochlorite CAS Name: thiohypochlorous acid [4-oxo-2-(1-pyrazolyl)-1-benzopyran-6-yl] ester IUPAC Name: (4-oxo-2-pyrazol-1-ylchromen-6-yl) thiohypochlorite Traditional Name: thiohypochlorous acid (4-keto-2-pyrazol-1-yl-chromen-6-yl) ester Formula: C12H7ClN2O2S MolecularWeight: 278.71418

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(N=C1)C2=CC(=O)C3=C(O2)C=CC(=C3)SCl

Isomeric SMILES

C1=CN(N=C1)C2=CC(=O)C3=C(O2)C=CC(=C3)SCl

InChI

InChI=1S/C12H7ClN2O2S/c13-18-8-2-3-11-9(6-8)10(16)7-12(17-11)15-5-1-4-14-15/h1-7H