6,8-dimethyl-3-(3-oxidanylprop-1-ynyl)pyrimido[4,5-c]pyridazine-5,7-dione

Systemtic Name: 6,8-dimethyl-3-(3-oxidanylprop-1-ynyl)pyrimido[4,5-c]pyridazine-5,7-dione Openeye Name: 3-(3-hydroxyprop-1-ynyl)-6,8-dimethyl-pyrimido[4,5-c]pyridazine-5,7-dione CAS Name: 3-(3-hydroxyprop-1-ynyl)-6,8-dimethylpyrimido[4,5-c]pyridazine-5,7-dione IUPAC Name: 3-(3-hydroxyprop-1-ynyl)-6,8-dimethylpyrimido[4,5-c]pyridazine-5,7-dione Traditional Name: 3-(3-hydroxyprop-1-ynyl)-6,8-dimethyl-pyrimido[4,5-c]pyridazine-5,7-quinone Formula: C11H10N4O3 MolecularWeight: 246.2221

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(N=N2)C#CCO)C(=O)N(C1=O)C

Isomeric SMILES

CN1C2=C(C=C(N=N2)C#CCO)C(=O)N(C1=O)C

InChI

InChI=1S/C11H10N4O3/c1-14-9-8(10(17)15(2)11(14)18)6-7(12-13-9)4-3-5-16/h6,16H,5H2,1-2H3