4-[2-(4-nitroimidazol-1-yl)ethoxy]benzenecarbonitrile

Systemtic Name: 4-[2-(4-nitroimidazol-1-yl)ethoxy]benzenecarbonitrile Openeye Name: 4-[2-(4-nitroimidazol-1-yl)ethoxy]benzonitrile CAS Name: 4-[2-(4-nitro-1-imidazolyl)ethoxy]benzonitrile IUPAC Name: 4-[2-(4-nitroimidazol-1-yl)ethoxy]benzonitrile Traditional Name: 4-[2-(4-nitroimidazol-1-yl)ethoxy]benzonitrile Formula: C12H10N4O3 MolecularWeight: 258.2328

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#N)OCCN2C=C(N=C2)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C#N)OCCN2C=C(N=C2)[N+](=O)[O-]

InChI

InChI=1S/C12H10N4O3/c13-7-10-1-3-11(4-2-10)19-6-5-15-8-12(14-9-15)16(17)18/h1-4,8-9H,5-6H2