2-[4-[2-(hydroxymethyl)-6,7-dimethoxy-naphthalen-1-yl]pyridin-2-yl]-4-pyridin-3-yl-phthalazin-1-one chloride

Systemtic Name: 2-[4-[2-(hydroxymethyl)-6,7-dimethoxy-naphthalen-1-yl]pyridin-2-yl]-4-pyridin-3-yl-phthalazin-1-one chloride Openeye Name: 2-[4-[2-(hydroxymethyl)-6,7-dimethoxy-1-naphthyl]-2-pyridyl]-4-(3-pyridyl)phthalazin-1-one chloride CAS Name: 2-[4-[2-(hydroxymethyl)-6,7-dimethoxy-1-naphthalenyl]-2-pyridinyl]-4-(3-pyridinyl)-1-phthalazinone chloride IUPAC Name: 2-[4-[2-(hydroxymethyl)-6,7-dimethoxynaphthalen-1-yl]pyridin-2-yl]-4-pyridin-3-ylphthalazin-1-one chloride Traditional Name: 2-[4-(6,7-dimethoxy-2-methylol-1-naphthyl)-2-pyridyl]-4-(3-pyridyl)phthalazin-1-one chloride Formula: C31H24ClN4O4- MolecularWeight: 551.99966

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C31H24N4O4.ClH/c1-38-26-14-19-9-10-22(18-36)29(25(19)16-27(26)39-2)20-11-13-33-28(15-20)35-31(37)24-8-4-3-7-23(24)30(34-35)21-6-5-12-32-17-21;/h3-17,36H,18H2,1-2H3;1H/p-1