6-(4-methoxyphenyl)-2-[[1-(3-methoxyphenyl)carbonylpiperidin-4-yl]methyl]pyridazin-3-one

Systemtic Name: 6-(4-methoxyphenyl)-2-[[1-(3-methoxyphenyl)carbonylpiperidin-4-yl]methyl]pyridazin-3-one Openeye Name: 2-[[1-(3-methoxybenzoyl)-4-piperidyl]methyl]-6-(4-methoxyphenyl)pyridazin-3-one CAS Name: 6-(4-methoxyphenyl)-2-[[1-[(3-methoxyphenyl)-oxomethyl]-4-piperidinyl]methyl]-3-pyridazinone IUPAC Name: 2-[[1-(3-methoxybenzoyl)piperidin-4-yl]methyl]-6-(4-methoxyphenyl)pyridazin-3-one Traditional Name: 2-[(1-m-anisoyl-4-piperidyl)methyl]-6-(4-methoxyphenyl)pyridazin-3-one Formula: C25H27N3O4 MolecularWeight: 433.49958

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NN(C(=O)C=C2)CC3CCN(CC3)C(=O)C4=CC(=CC=C4)OC

Isomeric SMILES

COC1=CC=C(C=C1)C2=NN(C(=O)C=C2)CC3CCN(CC3)C(=O)C4=CC(=CC=C4)OC

InChI

InChI=1S/C25H27N3O4/c1-31-21-8-6-19(7-9-21)23-10-11-24(29)28(26-23)17-18-12-14-27(15-13-18)25(30)20-4-3-5-22(16-20)32-2/h3-11,16,18H,12-15,17H2,1-2H3