5-(phenylcarbonyl)-2-[2-[1-(phenylmethyl)piperidin-4-yl]ethyl]isoindole-1,3-dione

Systemtic Name: 5-(phenylcarbonyl)-2-[2-[1-(phenylmethyl)piperidin-4-yl]ethyl]isoindole-1,3-dione Openeye Name: 5-benzoyl-2-[2-(1-benzyl-4-piperidyl)ethyl]isoindoline-1,3-dione CAS Name: 5-benzoyl-2-[2-[1-(phenylmethyl)-4-piperidinyl]ethyl]isoindole-1,3-dione IUPAC Name: 5-benzoyl-2-[2-(1-benzylpiperidin-4-yl)ethyl]isoindole-1,3-dione Traditional Name: 5-benzoyl-2-[2-(1-benzyl-4-piperidyl)ethyl]isoindoline-1,3-quinone Formula: C29H28N2O3 MolecularWeight: 452.54422

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CCN2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)C4=CC=CC=C4)CC5=CC=CC=C5

Isomeric SMILES

C1CN(CCC1CCN2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)C4=CC=CC=C4)CC5=CC=CC=C5

InChI

InChI=1S/C29H28N2O3/c32-27(23-9-5-2-6-10-23)24-11-12-25-26(19-24)29(34)31(28(25)33)18-15-21-13-16-30(17-14-21)20-22-7-3-1-4-8-22/h1-12,19,21H,13-18,20H2