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

Systemtic Name: 6,8-dimethyl-3-oct-1-ynyl-pyrimido[4,5-c]pyridazine-5,7-dione Openeye Name: 6,8-dimethyl-3-oct-1-ynyl-pyrimido[4,5-c]pyridazine-5,7-dione CAS Name: 6,8-dimethyl-3-oct-1-ynylpyrimido[4,5-c]pyridazine-5,7-dione IUPAC Name: 6,8-dimethyl-3-oct-1-ynylpyrimido[4,5-c]pyridazine-5,7-dione Traditional Name: 6,8-dimethyl-3-oct-1-ynyl-pyrimido[4,5-c]pyridazine-5,7-quinone Formula: C16H20N4O2 MolecularWeight: 300.3556

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC#CC1=CC2=C(N=N1)N(C(=O)N(C2=O)C)C

Isomeric SMILES

CCCCCCC#CC1=CC2=C(N=N1)N(C(=O)N(C2=O)C)C

InChI

InChI=1S/C16H20N4O2/c1-4-5-6-7-8-9-10-12-11-13-14(18-17-12)19(2)16(22)20(3)15(13)21/h11H,4-8H2,1-3H3