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

Systemtic Name: 2-[4-[6,7-diethoxy-3-(hydroxymethyl)naphthalen-1-yl]pyridin-2-yl]-4-phenyl-phthalazin-1-one Openeye Name: 2-[4-[6,7-diethoxy-3-(hydroxymethyl)-1-naphthyl]-2-pyridyl]-4-phenyl-phthalazin-1-one CAS Name: 2-[4-[6,7-diethoxy-3-(hydroxymethyl)-1-naphthalenyl]-2-pyridinyl]-4-phenyl-1-phthalazinone IUPAC Name: 2-[4-[6,7-diethoxy-3-(hydroxymethyl)naphthalen-1-yl]pyridin-2-yl]-4-phenylphthalazin-1-one Traditional Name: 2-[4-(6,7-diethoxy-3-methylol-1-naphthyl)-2-pyridyl]-4-phenyl-phthalazin-1-one Formula: C34H29N3O4 MolecularWeight: 543.61176

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=CC(=CC(=C2C=C1OCC)C3=CC(=NC=C3)N4C(=O)C5=CC=CC=C5C(=N4)C6=CC=CC=C6)CO

Isomeric SMILES

CCOC1=CC2=CC(=CC(=C2C=C1OCC)C3=CC(=NC=C3)N4C(=O)C5=CC=CC=C5C(=N4)C6=CC=CC=C6)CO

InChI

InChI=1S/C34H29N3O4/c1-3-40-30-18-25-16-22(21-38)17-28(29(25)20-31(30)41-4-2)24-14-15-35-32(19-24)37-34(39)27-13-9-8-12-26(27)33(36-37)23-10-6-5-7-11-23/h5-20,38H,3-4,21H2,1-2H3