6-(3,4-dimethoxyphenyl)-2-[[1-(2-methylpropanoyl)piperidin-4-yl]methyl]pyridazin-3-one

Systemtic Name: 6-(3,4-dimethoxyphenyl)-2-[[1-(2-methylpropanoyl)piperidin-4-yl]methyl]pyridazin-3-one Openeye Name: 6-(3,4-dimethoxyphenyl)-2-[[1-(2-methylpropanoyl)-4-piperidyl]methyl]pyridazin-3-one CAS Name: 6-(3,4-dimethoxyphenyl)-2-[[1-(2-methyl-1-oxopropyl)-4-piperidinyl]methyl]-3-pyridazinone IUPAC Name: 6-(3,4-dimethoxyphenyl)-2-[[1-(2-methylpropanoyl)piperidin-4-yl]methyl]pyridazin-3-one Traditional Name: 6-(3,4-dimethoxyphenyl)-2-[(1-isobutyryl-4-piperidyl)methyl]pyridazin-3-one Formula: C22H29N3O4 MolecularWeight: 399.48336

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N1CCC(CC1)CN2C(=O)C=CC(=N2)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC(C)C(=O)N1CCC(CC1)CN2C(=O)C=CC(=N2)C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C22H29N3O4/c1-15(2)22(27)24-11-9-16(10-12-24)14-25-21(26)8-6-18(23-25)17-5-7-19(28-3)20(13-17)29-4/h5-8,13,15-16H,9-12,14H2,1-4H3