(6-chloranyl-1-methyl-4-oxidanylidene-cinnolin-3-yl)sulfanylmethyl ethanoate

Systemtic Name: (6-chloranyl-1-methyl-4-oxidanylidene-cinnolin-3-yl)sulfanylmethyl ethanoate Openeye Name: (6-chloro-1-methyl-4-oxo-cinnolin-3-yl)sulfanylmethyl acetate CAS Name: acetic acid [(6-chloro-1-methyl-4-oxo-3-cinnolinyl)thio]methyl ester IUPAC Name: (6-chloro-1-methyl-4-oxocinnolin-3-yl)sulfanylmethyl acetate Traditional Name: acetic acid [(6-chloro-4-keto-1-methyl-cinnolin-3-yl)thio]methyl ester Formula: C12H11ClN2O3S MolecularWeight: 298.74534

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCSC1=NN(C2=C(C1=O)C=C(C=C2)Cl)C

Isomeric SMILES

CC(=O)OCSC1=NN(C2=C(C1=O)C=C(C=C2)Cl)C

InChI

InChI=1S/C12H11ClN2O3S/c1-7(16)18-6-19-12-11(17)9-5-8(13)3-4-10(9)15(2)14-12/h3-5H,6H2,1-2H3