3-[3-(3-bicyclo[2.2.1]heptanyloxy)-4-methoxy-phenyl]-1H-pyridazin-6-one

Systemtic Name: 3-[3-(3-bicyclo[2.2.1]heptanyloxy)-4-methoxy-phenyl]-1H-pyridazin-6-one Openeye Name: 3-(4-methoxy-3-norbornan-2-yloxy-phenyl)-1H-pyridazin-6-one CAS Name: 3-[3-(3-bicyclo[2.2.1]heptanyloxy)-4-methoxyphenyl]-1H-pyridazin-6-one IUPAC Name: 3-[3-(3-bicyclo[2.2.1]heptanyloxy)-4-methoxyphenyl]-1H-pyridazin-6-one Traditional Name: 3-[4-methoxy-3-(2-norbornyloxy)phenyl]-1H-pyridazin-6-one Formula: C18H20N2O3 MolecularWeight: 312.363

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NNC(=O)C=C2)OC3CC4CCC3C4

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NNC(=O)C=C2)OC3CC4CCC3C4

InChI

InChI=1S/C18H20N2O3/c1-22-15-6-4-12(14-5-7-18(21)20-19-14)10-17(15)23-16-9-11-2-3-13(16)8-11/h4-7,10-11,13,16H,2-3,8-9H2,1H3,(H,20,21)