2-(phenylmethyl)-5-(4-phenylpiperazin-1-yl)carbonyl-isoindole-1,3-dione

Systemtic Name: 2-(phenylmethyl)-5-(4-phenylpiperazin-1-yl)carbonyl-isoindole-1,3-dione Openeye Name: 2-benzyl-5-(4-phenylpiperazine-1-carbonyl)isoindoline-1,3-dione CAS Name: 5-[oxo-(4-phenyl-1-piperazinyl)methyl]-2-(phenylmethyl)isoindole-1,3-dione IUPAC Name: 2-benzyl-5-(4-phenylpiperazine-1-carbonyl)isoindole-1,3-dione Traditional Name: 2-benzyl-5-(4-phenylpiperazine-1-carbonyl)isoindoline-1,3-quinone Formula: C26H23N3O3 MolecularWeight: 425.47912

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C(=O)C3=CC4=C(C=C3)C(=O)N(C4=O)CC5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C(=O)C3=CC4=C(C=C3)C(=O)N(C4=O)CC5=CC=CC=C5

InChI

InChI=1S/C26H23N3O3/c30-24(28-15-13-27(14-16-28)21-9-5-2-6-10-21)20-11-12-22-23(17-20)26(32)29(25(22)31)18-19-7-3-1-4-8-19/h1-12,17H,13-16,18H2