[(1-ethanoyl-6,7-dimethoxy-4-oxidanylidene-cinnolin-3-yl)sulfanyl-oxidanyl-methyl] ethanoate

Systemtic Name: [(1-ethanoyl-6,7-dimethoxy-4-oxidanylidene-cinnolin-3-yl)sulfanyl-oxidanyl-methyl] ethanoate Openeye Name: [(1-acetyl-6,7-dimethoxy-4-oxo-cinnolin-3-yl)sulfanyl-hydroxy-methyl] acetate CAS Name: acetic acid [[(1-acetyl-6,7-dimethoxy-4-oxo-3-cinnolinyl)thio]-hydroxymethyl] ester IUPAC Name: [(1-acetyl-6,7-dimethoxy-4-oxocinnolin-3-yl)sulfanyl-hydroxymethyl] acetate Traditional Name: acetic acid [[(1-acetyl-4-keto-6,7-dimethoxy-cinnolin-3-yl)thio]-hydroxy-methyl] ester Formula: C15H16N2O7S MolecularWeight: 368.36174

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C2=CC(=C(C=C2C(=O)C(=N1)SC(O)OC(=O)C)OC)OC

Isomeric SMILES

CC(=O)N1C2=CC(=C(C=C2C(=O)C(=N1)SC(O)OC(=O)C)OC)OC

InChI

InChI=1S/C15H16N2O7S/c1-7(18)17-10-6-12(23-4)11(22-3)5-9(10)13(20)14(16-17)25-15(21)24-8(2)19/h5-6,15,21H,1-4H3