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

Systemtic Name: 4-[4-(2-oxidanylidene-3H-benzimidazol-1-yl)piperidin-1-yl]carbonyl-2-(phenylmethyl)phthalazin-1-one Openeye Name: 2-benzyl-4-[4-(2-oxo-3H-benzimidazol-1-yl)piperidine-1-carbonyl]phthalazin-1-one CAS Name: 4-[oxo-[4-(2-oxo-3H-benzimidazol-1-yl)-1-piperidinyl]methyl]-2-(phenylmethyl)-1-phthalazinone IUPAC Name: 2-benzyl-4-[4-(2-oxo-3H-benzimidazol-1-yl)piperidine-1-carbonyl]phthalazin-1-one Traditional Name: 2-benzyl-4-[4-(2-keto-3H-benzimidazol-1-yl)piperidine-1-carbonyl]phthalazin-1-one Formula: C28H25N5O3 MolecularWeight: 479.5298

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N2C3=CC=CC=C3NC2=O)C(=O)C4=NN(C(=O)C5=CC=CC=C54)CC6=CC=CC=C6

Isomeric SMILES

C1CN(CCC1N2C3=CC=CC=C3NC2=O)C(=O)C4=NN(C(=O)C5=CC=CC=C54)CC6=CC=CC=C6

InChI

InChI=1S/C28H25N5O3/c34-26-22-11-5-4-10-21(22)25(30-32(26)18-19-8-2-1-3-9-19)27(35)31-16-14-20(15-17-31)33-24-13-7-6-12-23(24)29-28(33)36/h1-13,20H,14-18H2,(H,29,36)