2-[3-(3-methylphenoxy)-2-oxidanyl-propyl]-4-(4-methylphenyl)phthalazin-1-one

Systemtic Name: 2-[3-(3-methylphenoxy)-2-oxidanyl-propyl]-4-(4-methylphenyl)phthalazin-1-one Openeye Name: 2-[2-hydroxy-3-(3-methylphenoxy)propyl]-4-(p-tolyl)phthalazin-1-one CAS Name: 2-[2-hydroxy-3-(3-methylphenoxy)propyl]-4-(4-methylphenyl)-1-phthalazinone IUPAC Name: 2-[2-hydroxy-3-(3-methylphenoxy)propyl]-4-(4-methylphenyl)phthalazin-1-one Traditional Name: 2-[2-hydroxy-3-(3-methylphenoxy)propyl]-4-(p-tolyl)phthalazin-1-one Formula: C25H24N2O3 MolecularWeight: 400.46966

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN(C(=O)C3=CC=CC=C32)CC(COC4=CC=CC(=C4)C)O

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN(C(=O)C3=CC=CC=C32)CC(COC4=CC=CC(=C4)C)O

InChI

InChI=1S/C25H24N2O3/c1-17-10-12-19(13-11-17)24-22-8-3-4-9-23(22)25(29)27(26-24)15-20(28)16-30-21-7-5-6-18(2)14-21/h3-14,20,28H,15-16H2,1-2H3