2-(naphthalen-1-ylmethyl)-4-[4-(4-oxidanylidenepentanoyl)piperazin-1-yl]isoindole-1,3-dione

Systemtic Name: 2-(naphthalen-1-ylmethyl)-4-[4-(4-oxidanylidenepentanoyl)piperazin-1-yl]isoindole-1,3-dione Openeye Name: 2-(1-naphthylmethyl)-4-[4-(4-oxopentanoyl)piperazin-1-yl]isoindoline-1,3-dione CAS Name: 4-[4-(1,4-dioxopentyl)-1-piperazinyl]-2-(1-naphthalenylmethyl)isoindole-1,3-dione IUPAC Name: 2-(naphthalen-1-ylmethyl)-4-[4-(4-oxopentanoyl)piperazin-1-yl]isoindole-1,3-dione Traditional Name: 4-[4-(4-ketopentanoyl)piperazino]-2-(1-naphthylmethyl)isoindoline-1,3-quinone Formula: C28H27N3O4 MolecularWeight: 469.53168

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCC(=O)N1CCN(CC1)C2=CC=CC3=C2C(=O)N(C3=O)CC4=CC=CC5=CC=CC=C54

Isomeric SMILES

CC(=O)CCC(=O)N1CCN(CC1)C2=CC=CC3=C2C(=O)N(C3=O)CC4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C28H27N3O4/c1-19(32)12-13-25(33)30-16-14-29(15-17-30)24-11-5-10-23-26(24)28(35)31(27(23)34)18-21-8-4-7-20-6-2-3-9-22(20)21/h2-11H,12-18H2,1H3