4-[4-(2-chlorophenyl)piperazin-1-yl]carbonyl-2-(phenylmethyl)phthalazin-1-one

Systemtic Name: 4-[4-(2-chlorophenyl)piperazin-1-yl]carbonyl-2-(phenylmethyl)phthalazin-1-one Openeye Name: 2-benzyl-4-[4-(2-chlorophenyl)piperazine-1-carbonyl]phthalazin-1-one CAS Name: 4-[[4-(2-chlorophenyl)-1-piperazinyl]-oxomethyl]-2-(phenylmethyl)-1-phthalazinone IUPAC Name: 2-benzyl-4-[4-(2-chlorophenyl)piperazine-1-carbonyl]phthalazin-1-one Traditional Name: 2-benzyl-4-[4-(2-chlorophenyl)piperazine-1-carbonyl]phthalazin-1-one Formula: C26H23ClN4O2 MolecularWeight: 458.93942

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2Cl)C(=O)C3=NN(C(=O)C4=CC=CC=C43)CC5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2Cl)C(=O)C3=NN(C(=O)C4=CC=CC=C43)CC5=CC=CC=C5

InChI

InChI=1S/C26H23ClN4O2/c27-22-12-6-7-13-23(22)29-14-16-30(17-15-29)26(33)24-20-10-4-5-11-21(20)25(32)31(28-24)18-19-8-2-1-3-9-19/h1-13H,14-18H2