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2-[5-nitro-1-(phenylmethyl)benzimidazol-4-yl]ethanenitrile

2-[5-nitro-1-(phenylmethyl)benzimidazol-4-yl]ethanenitrile

Systemtic Name:2-[5-nitro-1-(phenylmethyl)benzimidazol-4-yl]ethanenitrile
Openeye Name:2-(1-benzyl-5-nitro-benzimidazol-4-yl)acetonitrile
CAS Name:2-[5-nitro-1-(phenylmethyl)-4-benzimidazolyl]acetonitrile
IUPAC Name:2-(1-benzyl-5-nitrobenzimidazol-4-yl)acetonitrile
Traditional Name:2-(1-benzyl-5-nitro-benzimidazol-4-yl)acetonitrile
Formula: C16H12N4O2
MolecularWeight: 292.29208
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=NC3=C2C=CC(=C3CC#N)[N+](=O)[O-]


Isomeric SMILES

C1=CC=C(C=C1)CN2C=NC3=C2C=CC(=C3CC#N)[N+](=O)[O-]


InChI

InChI=1S/C16H12N4O2/c17-9-8-13-14(20(21)22)6-7-15-16(13)18-11-19(15)10-12-4-2-1-3-5-12/h1-7,11H,8,10H2


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