[(6-chloranyl-1-methyl-4-oxidanylidene-cinnolin-3-yl)sulfanyl-oxidanyl-methyl] ethanoate

Systemtic Name: [(6-chloranyl-1-methyl-4-oxidanylidene-cinnolin-3-yl)sulfanyl-oxidanyl-methyl] ethanoate Openeye Name: [(6-chloro-1-methyl-4-oxo-cinnolin-3-yl)sulfanyl-hydroxy-methyl] acetate CAS Name: acetic acid [[(6-chloro-1-methyl-4-oxo-3-cinnolinyl)thio]-hydroxymethyl] ester IUPAC Name: [(6-chloro-1-methyl-4-oxocinnolin-3-yl)sulfanyl-hydroxymethyl] acetate Traditional Name: acetic acid [[(6-chloro-4-keto-1-methyl-cinnolin-3-yl)thio]-hydroxy-methyl] ester Formula: C12H11ClN2O4S MolecularWeight: 314.74474

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(O)SC1=NN(C2=C(C1=O)C=C(C=C2)Cl)C

Isomeric SMILES

CC(=O)OC(O)SC1=NN(C2=C(C1=O)C=C(C=C2)Cl)C

InChI

InChI=1S/C12H11ClN2O4S/c1-6(16)19-12(18)20-11-10(17)8-5-7(13)3-4-9(8)15(2)14-11/h3-5,12,18H,1-2H3