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

Systemtic Name: 1-[5-nitro-1-(phenylmethyl)benzimidazol-2-yl]ethanone Openeye Name: 1-(1-benzyl-5-nitro-benzimidazol-2-yl)ethanone CAS Name: 1-[5-nitro-1-(phenylmethyl)-2-benzimidazolyl]ethanone IUPAC Name: 1-(1-benzyl-5-nitrobenzimidazol-2-yl)ethanone Traditional Name: 1-(1-benzyl-5-nitro-benzimidazol-2-yl)ethanone Formula: C16H13N3O3 MolecularWeight: 295.29272

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=NC2=C(N1CC3=CC=CC=C3)C=CC(=C2)[N+](=O)[O-]

Isomeric SMILES

CC(=O)C1=NC2=C(N1CC3=CC=CC=C3)C=CC(=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H13N3O3/c1-11(20)16-17-14-9-13(19(21)22)7-8-15(14)18(16)10-12-5-3-2-4-6-12/h2-9H,10H2,1H3