3-[(1-ethyl-5-nitro-imidazol-2-yl)methoxy]benzenecarbonitrile

Systemtic Name: 3-[(1-ethyl-5-nitro-imidazol-2-yl)methoxy]benzenecarbonitrile Openeye Name: 3-[(1-ethyl-5-nitro-imidazol-2-yl)methoxy]benzonitrile CAS Name: 3-[(1-ethyl-5-nitro-2-imidazolyl)methoxy]benzonitrile IUPAC Name: 3-[(1-ethyl-5-nitroimidazol-2-yl)methoxy]benzonitrile Traditional Name: 3-[(1-ethyl-5-nitro-imidazol-2-yl)methoxy]benzonitrile Formula: C13H12N4O3 MolecularWeight: 272.25938

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CN=C1COC2=CC=CC(=C2)C#N)[N+](=O)[O-]

Isomeric SMILES

CCN1C(=CN=C1COC2=CC=CC(=C2)C#N)[N+](=O)[O-]

InChI

InChI=1S/C13H12N4O3/c1-2-16-12(15-8-13(16)17(18)19)9-20-11-5-3-4-10(6-11)7-14/h3-6,8H,2,9H2,1H3