2-[2-(2-nitroimidazol-1-yl)ethoxy]isoindole-1,3-dione

Systemtic Name: 2-[2-(2-nitroimidazol-1-yl)ethoxy]isoindole-1,3-dione Openeye Name: 2-[2-(2-nitroimidazol-1-yl)ethoxy]isoindoline-1,3-dione CAS Name: 2-[2-(2-nitro-1-imidazolyl)ethoxy]isoindole-1,3-dione IUPAC Name: 2-[2-(2-nitroimidazol-1-yl)ethoxy]isoindole-1,3-dione Traditional Name: 2-[2-(2-nitroimidazol-1-yl)ethoxy]isoindoline-1,3-quinone Formula: C13H10N4O5 MolecularWeight: 302.2423

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)OCCN3C=CN=C3[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)OCCN3C=CN=C3[N+](=O)[O-]

InChI

InChI=1S/C13H10N4O5/c18-11-9-3-1-2-4-10(9)12(19)16(11)22-8-7-15-6-5-14-13(15)17(20)21/h1-6H,7-8H2