4,4-dimethoxy-1-[2-[3-[4-(oxan-2-yloxy)but-2-ynoyl]pyridin-2-yl]pyridin-3-yl]but-2-yn-1-one

Systemtic Name: 4,4-dimethoxy-1-[2-[3-[4-(oxan-2-yloxy)but-2-ynoyl]pyridin-2-yl]pyridin-3-yl]but-2-yn-1-one Openeye Name: 4,4-dimethoxy-1-[2-[3-(4-tetrahydropyran-2-yloxybut-2-ynoyl)-2-pyridyl]-3-pyridyl]but-2-yn-1-one CAS Name: 4,4-dimethoxy-1-[2-[3-[4-(2-oxanyloxy)-1-oxobut-2-ynyl]-2-pyridinyl]-3-pyridinyl]-2-butyn-1-one IUPAC Name: 4,4-dimethoxy-1-[2-[3-[4-(oxan-2-yloxy)but-2-ynoyl]pyridin-2-yl]pyridin-3-yl]but-2-yn-1-one Traditional Name: 4,4-dimethoxy-1-[2-[3-(4-tetrahydropyran-2-yloxybut-2-ynoyl)-2-pyridyl]-3-pyridyl]but-2-yn-1-one Formula: C25H24N2O6 MolecularWeight: 448.46786

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Descriptors Computed from Structure

Canonical SMILES:

COC(C#CC(=O)C1=C(N=CC=C1)C2=C(C=CC=N2)C(=O)C#CCOC3CCCCO3)OC

Isomeric SMILES

COC(C#CC(=O)C1=C(N=CC=C1)C2=C(C=CC=N2)C(=O)C#CCOC3CCCCO3)OC

InChI

InChI=1S/C25H24N2O6/c1-30-22(31-2)13-12-21(29)19-9-6-15-27-25(19)24-18(8-5-14-26-24)20(28)10-7-17-33-23-11-3-4-16-32-23/h5-6,8-9,14-15,22-23H,3-4,11,16-17H2,1-2H3