2-[4-(6,7-dimethoxyphthalazin-1-yl)pyridin-2-yl]-4-pyridin-3-yl-phthalazin-1-one hydrochloride

Systemtic Name: 2-[4-(6,7-dimethoxyphthalazin-1-yl)pyridin-2-yl]-4-pyridin-3-yl-phthalazin-1-one hydrochloride Openeye Name: 2-[4-(6,7-dimethoxyphthalazin-1-yl)-2-pyridyl]-4-(3-pyridyl)phthalazin-1-one hydrochloride CAS Name: 2-[4-(6,7-dimethoxy-1-phthalazinyl)-2-pyridinyl]-4-(3-pyridinyl)-1-phthalazinone hydrochloride IUPAC Name: 2-[4-(6,7-dimethoxyphthalazin-1-yl)pyridin-2-yl]-4-pyridin-3-ylphthalazin-1-one hydrochloride Traditional Name: 2-[4-(6,7-dimethoxyphthalazin-1-yl)-2-pyridyl]-4-(3-pyridyl)phthalazin-1-one hydrochloride Formula: C28H21ClN6O3 MolecularWeight: 524.95774

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C=NN=C2C3=CC(=NC=C3)N4C(=O)C5=CC=CC=C5C(=N4)C6=CN=CC=C6)OC.Cl

Isomeric SMILES

COC1=C(C=C2C(=C1)C=NN=C2C3=CC(=NC=C3)N4C(=O)C5=CC=CC=C5C(=N4)C6=CN=CC=C6)OC.Cl

InChI

InChI=1S/C28H20N6O3.ClH/c1-36-23-12-19-16-31-32-26(22(19)14-24(23)37-2)17-9-11-30-25(13-17)34-28(35)21-8-4-3-7-20(21)27(33-34)18-6-5-10-29-15-18;/h3-16H,1-2H3;1H