6,8-dimethyl-3-[3-(oxan-2-yloxy)prop-1-ynyl]pyrimido[4,5-c]pyridazine-5,7-dione

Systemtic Name: 6,8-dimethyl-3-[3-(oxan-2-yloxy)prop-1-ynyl]pyrimido[4,5-c]pyridazine-5,7-dione Openeye Name: 6,8-dimethyl-3-(3-tetrahydropyran-2-yloxyprop-1-ynyl)pyrimido[4,5-c]pyridazine-5,7-dione CAS Name: 6,8-dimethyl-3-[3-(2-oxanyloxy)prop-1-ynyl]pyrimido[4,5-c]pyridazine-5,7-dione IUPAC Name: 6,8-dimethyl-3-[3-(oxan-2-yloxy)prop-1-ynyl]pyrimido[4,5-c]pyridazine-5,7-dione Traditional Name: 6,8-dimethyl-3-(3-tetrahydropyran-2-yloxyprop-1-ynyl)pyrimido[4,5-c]pyridazine-5,7-quinone Formula: C16H18N4O4 MolecularWeight: 330.33852

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(N=N2)C#CCOC3CCCCO3)C(=O)N(C1=O)C

Isomeric SMILES

CN1C2=C(C=C(N=N2)C#CCOC3CCCCO3)C(=O)N(C1=O)C

InChI

InChI=1S/C16H18N4O4/c1-19-14-12(15(21)20(2)16(19)22)10-11(17-18-14)6-5-9-24-13-7-3-4-8-23-13/h10,13H,3-4,7-9H2,1-2H3