2-(phenylmethyl)-4-(2-pyridin-4-ylpyrrolidin-1-yl)carbonyl-phthalazin-1-one

Systemtic Name: 2-(phenylmethyl)-4-(2-pyridin-4-ylpyrrolidin-1-yl)carbonyl-phthalazin-1-one Openeye Name: 2-benzyl-4-[2-(4-pyridyl)pyrrolidine-1-carbonyl]phthalazin-1-one CAS Name: 4-[oxo-(2-pyridin-4-yl-1-pyrrolidinyl)methyl]-2-(phenylmethyl)-1-phthalazinone IUPAC Name: 2-benzyl-4-(2-pyridin-4-ylpyrrolidine-1-carbonyl)phthalazin-1-one Traditional Name: 2-benzyl-4-[2-(4-pyridyl)pyrrolidine-1-carbonyl]phthalazin-1-one Formula: C25H22N4O2 MolecularWeight: 410.46778

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C2=NN(C(=O)C3=CC=CC=C32)CC4=CC=CC=C4)C5=CC=NC=C5

Isomeric SMILES

C1CC(N(C1)C(=O)C2=NN(C(=O)C3=CC=CC=C32)CC4=CC=CC=C4)C5=CC=NC=C5

InChI

InChI=1S/C25H22N4O2/c30-24-21-10-5-4-9-20(21)23(27-29(24)17-18-7-2-1-3-8-18)25(31)28-16-6-11-22(28)19-12-14-26-15-13-19/h1-5,7-10,12-15,22H,6,11,16-17H2