4-[4-(3-methoxyphenyl)carbonylpiperazin-1-yl]carbonyl-2-phenyl-phthalazin-1-one

Systemtic Name: 4-[4-(3-methoxyphenyl)carbonylpiperazin-1-yl]carbonyl-2-phenyl-phthalazin-1-one Openeye Name: 4-[4-(3-methoxybenzoyl)piperazine-1-carbonyl]-2-phenyl-phthalazin-1-one CAS Name: 4-[[4-[(3-methoxyphenyl)-oxomethyl]-1-piperazinyl]-oxomethyl]-2-phenyl-1-phthalazinone IUPAC Name: 4-[4-(3-methoxybenzoyl)piperazine-1-carbonyl]-2-phenylphthalazin-1-one Traditional Name: 4-(4-m-anisoylpiperazine-1-carbonyl)-2-phenyl-phthalazin-1-one Formula: C27H24N4O4 MolecularWeight: 468.50386

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=O)N2CCN(CC2)C(=O)C3=NN(C(=O)C4=CC=CC=C43)C5=CC=CC=C5

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)N2CCN(CC2)C(=O)C3=NN(C(=O)C4=CC=CC=C43)C5=CC=CC=C5

InChI

InChI=1S/C27H24N4O4/c1-35-21-11-7-8-19(18-21)25(32)29-14-16-30(17-15-29)27(34)24-22-12-5-6-13-23(22)26(33)31(28-24)20-9-3-2-4-10-20/h2-13,18H,14-17H2,1H3