4-[4-(4-hydroxyphenyl)carbonylpiperazin-1-yl]carbonyl-2-phenyl-phthalazin-1-one

Systemtic Name: 4-[4-(4-hydroxyphenyl)carbonylpiperazin-1-yl]carbonyl-2-phenyl-phthalazin-1-one Openeye Name: 4-[4-(4-hydroxybenzoyl)piperazine-1-carbonyl]-2-phenyl-phthalazin-1-one CAS Name: 4-[[4-[(4-hydroxyphenyl)-oxomethyl]-1-piperazinyl]-oxomethyl]-2-phenyl-1-phthalazinone IUPAC Name: 4-[4-(4-hydroxybenzoyl)piperazine-1-carbonyl]-2-phenylphthalazin-1-one Traditional Name: 4-[4-(4-hydroxybenzoyl)piperazine-1-carbonyl]-2-phenyl-phthalazin-1-one Formula: C26H22N4O4 MolecularWeight: 454.47728

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC=C(C=C2)O)C(=O)C3=NN(C(=O)C4=CC=CC=C43)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC=C(C=C2)O)C(=O)C3=NN(C(=O)C4=CC=CC=C43)C5=CC=CC=C5

InChI

InChI=1S/C26H22N4O4/c31-20-12-10-18(11-13-20)24(32)28-14-16-29(17-15-28)26(34)23-21-8-4-5-9-22(21)25(33)30(27-23)19-6-2-1-3-7-19/h1-13,31H,14-17H2