3-[4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazin-1-yl]carbonyl-1H-pyridazin-6-one

Systemtic Name: 3-[4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazin-1-yl]carbonyl-1H-pyridazin-6-one Openeye Name: 3-[4-(2,3-dihydrobenzofuran-5-ylmethyl)piperazine-1-carbonyl]-1H-pyridazin-6-one CAS Name: 3-[[4-(2,3-dihydrobenzofuran-5-ylmethyl)-1-piperazinyl]-oxomethyl]-1H-pyridazin-6-one IUPAC Name: 3-[4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazine-1-carbonyl]-1H-pyridazin-6-one Traditional Name: 3-[4-(coumaran-5-ylmethyl)piperazine-1-carbonyl]-1H-pyridazin-6-one Formula: C18H20N4O3 MolecularWeight: 340.3764

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C1C=C(C=C2)CN3CCN(CC3)C(=O)C4=NNC(=O)C=C4

Isomeric SMILES

C1COC2=C1C=C(C=C2)CN3CCN(CC3)C(=O)C4=NNC(=O)C=C4

InChI

InChI=1S/C18H20N4O3/c23-17-4-2-15(19-20-17)18(24)22-8-6-21(7-9-22)12-13-1-3-16-14(11-13)5-10-25-16/h1-4,11H,5-10,12H2,(H,20,23)