2-[2-(3,5-dimethylpiperidin-1-yl)-2-oxidanylidene-ethyl]-4-(pyridin-3-ylmethyl)phthalazin-1-one

Systemtic Name: 2-[2-(3,5-dimethylpiperidin-1-yl)-2-oxidanylidene-ethyl]-4-(pyridin-3-ylmethyl)phthalazin-1-one Openeye Name: 2-[2-(3,5-dimethyl-1-piperidyl)-2-oxo-ethyl]-4-(3-pyridylmethyl)phthalazin-1-one CAS Name: 2-[2-(3,5-dimethyl-1-piperidinyl)-2-oxoethyl]-4-(3-pyridinylmethyl)-1-phthalazinone IUPAC Name: 2-[2-(3,5-dimethylpiperidin-1-yl)-2-oxoethyl]-4-(pyridin-3-ylmethyl)phthalazin-1-one Traditional Name: 2-[2-(3,5-dimethylpiperidino)-2-keto-ethyl]-4-(3-pyridylmethyl)phthalazin-1-one Formula: C23H26N4O2 MolecularWeight: 390.47814

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)C(=O)CN2C(=O)C3=CC=CC=C3C(=N2)CC4=CN=CC=C4)C

Isomeric SMILES

CC1CC(CN(C1)C(=O)CN2C(=O)C3=CC=CC=C3C(=N2)CC4=CN=CC=C4)C

InChI

InChI=1S/C23H26N4O2/c1-16-10-17(2)14-26(13-16)22(28)15-27-23(29)20-8-4-3-7-19(20)21(25-27)11-18-6-5-9-24-12-18/h3-9,12,16-17H,10-11,13-15H2,1-2H3