2-(phenylmethyl)-4-(4-phenylpiperazin-1-yl)carbonyl-phthalazin-1-one

Systemtic Name: 2-(phenylmethyl)-4-(4-phenylpiperazin-1-yl)carbonyl-phthalazin-1-one Openeye Name: 2-benzyl-4-(4-phenylpiperazine-1-carbonyl)phthalazin-1-one CAS Name: 4-[oxo-(4-phenyl-1-piperazinyl)methyl]-2-(phenylmethyl)-1-phthalazinone IUPAC Name: 2-benzyl-4-(4-phenylpiperazine-1-carbonyl)phthalazin-1-one Traditional Name: 2-benzyl-4-(4-phenylpiperazine-1-carbonyl)phthalazin-1-one Formula: C26H24N4O2 MolecularWeight: 424.49436

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C(=O)C3=NN(C(=O)C4=CC=CC=C43)CC5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C(=O)C3=NN(C(=O)C4=CC=CC=C43)CC5=CC=CC=C5

InChI

InChI=1S/C26H24N4O2/c31-25-23-14-8-7-13-22(23)24(27-30(25)19-20-9-3-1-4-10-20)26(32)29-17-15-28(16-18-29)21-11-5-2-6-12-21/h1-14H,15-19H2