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

Systemtic Name: 2-[3-(4-ethoxyphenoxy)-2-oxidanyl-propyl]-4-(4-methylphenyl)phthalazin-1-one Openeye Name: 2-[3-(4-ethoxyphenoxy)-2-hydroxy-propyl]-4-(p-tolyl)phthalazin-1-one CAS Name: 2-[3-(4-ethoxyphenoxy)-2-hydroxypropyl]-4-(4-methylphenyl)-1-phthalazinone IUPAC Name: 2-[3-(4-ethoxyphenoxy)-2-hydroxypropyl]-4-(4-methylphenyl)phthalazin-1-one Traditional Name: 2-[3-(4-ethoxyphenoxy)-2-hydroxy-propyl]-4-(p-tolyl)phthalazin-1-one Formula: C26H26N2O4 MolecularWeight: 430.49564

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)OCC(CN2C(=O)C3=CC=CC=C3C(=N2)C4=CC=C(C=C4)C)O

Isomeric SMILES

CCOC1=CC=C(C=C1)OCC(CN2C(=O)C3=CC=CC=C3C(=N2)C4=CC=C(C=C4)C)O

InChI

InChI=1S/C26H26N2O4/c1-3-31-21-12-14-22(15-13-21)32-17-20(29)16-28-26(30)24-7-5-4-6-23(24)25(27-28)19-10-8-18(2)9-11-19/h4-15,20,29H,3,16-17H2,1-2H3