3-[4-(4-nitrophenyl)imidazol-1-yl]propanenitrile

Systemtic Name: 3-[4-(4-nitrophenyl)imidazol-1-yl]propanenitrile Openeye Name: 3-[4-(4-nitrophenyl)imidazol-1-yl]propanenitrile CAS Name: 3-[4-(4-nitrophenyl)-1-imidazolyl]propanenitrile IUPAC Name: 3-[4-(4-nitrophenyl)imidazol-1-yl]propanenitrile Traditional Name: 3-[4-(4-nitrophenyl)imidazol-1-yl]propionitrile Formula: C12H10N4O2 MolecularWeight: 242.2334

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=CN(C=N2)CCC#N)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C2=CN(C=N2)CCC#N)[N+](=O)[O-]

InChI

InChI=1S/C12H10N4O2/c13-6-1-7-15-8-12(14-9-15)10-2-4-11(5-3-10)16(17)18/h2-5,8-9H,1,7H2