2-methyl-4-[2-oxidanylidene-2-[4-(2-oxidanylidene-3H-benzimidazol-1-yl)piperidin-1-yl]ethyl]phthalazin-1-one

Systemtic Name: 2-methyl-4-[2-oxidanylidene-2-[4-(2-oxidanylidene-3H-benzimidazol-1-yl)piperidin-1-yl]ethyl]phthalazin-1-one Openeye Name: 2-methyl-4-[2-oxo-2-[4-(2-oxo-3H-benzimidazol-1-yl)-1-piperidyl]ethyl]phthalazin-1-one CAS Name: 2-methyl-4-[2-oxo-2-[4-(2-oxo-3H-benzimidazol-1-yl)-1-piperidinyl]ethyl]-1-phthalazinone IUPAC Name: 2-methyl-4-[2-oxo-2-[4-(2-oxo-3H-benzimidazol-1-yl)piperidin-1-yl]ethyl]phthalazin-1-one Traditional Name: 4-[2-keto-2-[4-(2-keto-3H-benzimidazol-1-yl)piperidino]ethyl]-2-methyl-phthalazin-1-one Formula: C23H23N5O3 MolecularWeight: 417.46042

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2C(=N1)CC(=O)N3CCC(CC3)N4C5=CC=CC=C5NC4=O

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2C(=N1)CC(=O)N3CCC(CC3)N4C5=CC=CC=C5NC4=O

InChI

InChI=1S/C23H23N5O3/c1-26-22(30)17-7-3-2-6-16(17)19(25-26)14-21(29)27-12-10-15(11-13-27)28-20-9-5-4-8-18(20)24-23(28)31/h2-9,15H,10-14H2,1H3,(H,24,31)