2-[3-(2,5-dimethylphenoxy)-2-oxidanyl-propyl]-4-phenyl-phthalazin-1-one

Systemtic Name: 2-[3-(2,5-dimethylphenoxy)-2-oxidanyl-propyl]-4-phenyl-phthalazin-1-one Openeye Name: 2-[3-(2,5-dimethylphenoxy)-2-hydroxy-propyl]-4-phenyl-phthalazin-1-one CAS Name: 2-[3-(2,5-dimethylphenoxy)-2-hydroxypropyl]-4-phenyl-1-phthalazinone IUPAC Name: 2-[3-(2,5-dimethylphenoxy)-2-hydroxypropyl]-4-phenylphthalazin-1-one Traditional Name: 2-[3-(2,5-dimethylphenoxy)-2-hydroxy-propyl]-4-phenyl-phthalazin-1-one Formula: C25H24N2O3 MolecularWeight: 400.46966

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)OCC(CN2C(=O)C3=CC=CC=C3C(=N2)C4=CC=CC=C4)O

Isomeric SMILES

CC1=CC(=C(C=C1)C)OCC(CN2C(=O)C3=CC=CC=C3C(=N2)C4=CC=CC=C4)O

InChI

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