2-[3-[4-(phenylmethyl)piperazin-1-yl]carbonylphenyl]isoindole-1,3-dione

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C(=O)C3=CC(=CC=C3)N4C(=O)C5=CC=CC=C5C4=O

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C(=O)C3=CC(=CC=C3)N4C(=O)C5=CC=CC=C5C4=O

InChI

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