2-[1-(3,4-diethoxyphenyl)-2-ethyl-imidazol-1-ium-1-yl]isoindole-1,3-dione

Systemtic Name: 2-[1-(3,4-diethoxyphenyl)-2-ethyl-imidazol-1-ium-1-yl]isoindole-1,3-dione Openeye Name: 2-[1-(3,4-diethoxyphenyl)-2-ethyl-imidazol-1-ium-1-yl]isoindoline-1,3-dione CAS Name: 2-[1-(3,4-diethoxyphenyl)-2-ethyl-1-imidazol-1-iumyl]isoindole-1,3-dione IUPAC Name: 2-[1-(3,4-diethoxyphenyl)-2-ethylimidazol-1-ium-1-yl]isoindole-1,3-dione Traditional Name: 2-[1-(3,4-diethoxyphenyl)-2-ethyl-imidazol-1-ium-1-yl]isoindoline-1,3-quinone Formula: C23H24N3O4+ MolecularWeight: 406.45436

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC=C[N+]1(C2=CC(=C(C=C2)OCC)OCC)N3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CCC1=NC=C[N+]1(C2=CC(=C(C=C2)OCC)OCC)N3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C23H24N3O4/c1-4-21-24-13-14-26(21,16-11-12-19(29-5-2)20(15-16)30-6-3)25-22(27)17-9-7-8-10-18(17)23(25)28/h7-15H,4-6H2,1-3H3/q+1