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

Systemtic Name: 2-[2-(3-methylpiperidin-1-yl)-2-oxidanylidene-ethyl]-4-(pyridin-4-ylmethyl)phthalazin-1-one Openeye Name: 2-[2-(3-methyl-1-piperidyl)-2-oxo-ethyl]-4-(4-pyridylmethyl)phthalazin-1-one CAS Name: 2-[2-(3-methyl-1-piperidinyl)-2-oxoethyl]-4-(pyridin-4-ylmethyl)-1-phthalazinone IUPAC Name: 2-[2-(3-methylpiperidin-1-yl)-2-oxoethyl]-4-(pyridin-4-ylmethyl)phthalazin-1-one Traditional Name: 2-[2-keto-2-(3-methylpiperidino)ethyl]-4-(4-pyridylmethyl)phthalazin-1-one Formula: C22H24N4O2 MolecularWeight: 376.45156

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C(=O)CN2C(=O)C3=CC=CC=C3C(=N2)CC4=CC=NC=C4

Isomeric SMILES

CC1CCCN(C1)C(=O)CN2C(=O)C3=CC=CC=C3C(=N2)CC4=CC=NC=C4

InChI

InChI=1S/C22H24N4O2/c1-16-5-4-12-25(14-16)21(27)15-26-22(28)19-7-3-2-6-18(19)20(24-26)13-17-8-10-23-11-9-17/h2-3,6-11,16H,4-5,12-15H2,1H3