2-[2-(3-phenethylimidazol-4-yl)ethyl]isoindole-1,3-dione

Systemtic Name: 2-[2-(3-phenethylimidazol-4-yl)ethyl]isoindole-1,3-dione Openeye Name: 2-[2-(3-phenethylimidazol-4-yl)ethyl]isoindoline-1,3-dione CAS Name: 2-[2-(3-phenethyl-4-imidazolyl)ethyl]isoindole-1,3-dione IUPAC Name: 2-[2-(3-phenethylimidazol-4-yl)ethyl]isoindole-1,3-dione Traditional Name: 2-[2-(3-phenethylimidazol-4-yl)ethyl]isoindoline-1,3-quinone Formula: C21H19N3O2 MolecularWeight: 345.39446

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCN2C=NC=C2CCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

C1=CC=C(C=C1)CCN2C=NC=C2CCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C21H19N3O2/c25-20-18-8-4-5-9-19(18)21(26)24(20)13-11-17-14-22-15-23(17)12-10-16-6-2-1-3-7-16/h1-9,14-15H,10-13H2