4-[4-(4,5-diphenylimidazol-1-yl)butyl]isoindole-1,3-dione

Systemtic Name: 4-[4-(4,5-diphenylimidazol-1-yl)butyl]isoindole-1,3-dione Openeye Name: 4-[4-(4,5-diphenylimidazol-1-yl)butyl]isoindoline-1,3-dione CAS Name: 4-[4-(4,5-diphenyl-1-imidazolyl)butyl]isoindole-1,3-dione IUPAC Name: 4-[4-(4,5-diphenylimidazol-1-yl)butyl]isoindole-1,3-dione Traditional Name: 4-[4-(4,5-diphenylimidazol-1-yl)butyl]isoindoline-1,3-quinone Formula: C27H23N3O2 MolecularWeight: 421.49042

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(N(C=N2)CCCCC3=CC=CC4=C3C(=O)NC4=O)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)C2=C(N(C=N2)CCCCC3=CC=CC4=C3C(=O)NC4=O)C5=CC=CC=C5

InChI

InChI=1S/C27H23N3O2/c31-26-22-16-9-15-19(23(22)27(32)29-26)10-7-8-17-30-18-28-24(20-11-3-1-4-12-20)25(30)21-13-5-2-6-14-21/h1-6,9,11-16,18H,7-8,10,17H2,(H,29,31,32)