4-[[3-[4-(2-hydroxyethyl)piperazin-1-yl]carbonylphenyl]methyl]-2H-phthalazin-1-one

Systemtic Name: 4-[[3-[4-(2-hydroxyethyl)piperazin-1-yl]carbonylphenyl]methyl]-2H-phthalazin-1-one Openeye Name: 4-[[3-[4-(2-hydroxyethyl)piperazine-1-carbonyl]phenyl]methyl]-2H-phthalazin-1-one CAS Name: 4-[[3-[[4-(2-hydroxyethyl)-1-piperazinyl]-oxomethyl]phenyl]methyl]-2H-phthalazin-1-one IUPAC Name: 4-[[3-[4-(2-hydroxyethyl)piperazine-1-carbonyl]phenyl]methyl]-2H-phthalazin-1-one Traditional Name: 4-[3-[4-(2-hydroxyethyl)piperazine-1-carbonyl]benzyl]-2H-phthalazin-1-one Formula: C22H24N4O3 MolecularWeight: 392.45096

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCO)C(=O)C2=CC(=CC=C2)CC3=NNC(=O)C4=CC=CC=C43

Isomeric SMILES

C1CN(CCN1CCO)C(=O)C2=CC(=CC=C2)CC3=NNC(=O)C4=CC=CC=C43

InChI

InChI=1S/C22H24N4O3/c27-13-12-25-8-10-26(11-9-25)22(29)17-5-3-4-16(14-17)15-20-18-6-1-2-7-19(18)21(28)24-23-20/h1-7,14,27H,8-13,15H2,(H,24,28)