5,6-dinitro-2-(phenylmethyl)-1H-benzimidazole

Systemtic Name: 5,6-dinitro-2-(phenylmethyl)-1H-benzimidazole Openeye Name: 2-benzyl-5,6-dinitro-1H-benzimidazole CAS Name: 5,6-dinitro-2-(phenylmethyl)-1H-benzimidazole IUPAC Name: 2-benzyl-5,6-dinitro-1H-benzimidazole Traditional Name: 2-benzyl-5,6-dinitro-1H-benzimidazole Formula: C14H10N4O4 MolecularWeight: 298.2536

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=NC3=CC(=C(C=C3N2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CC2=NC3=CC(=C(C=C3N2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C14H10N4O4/c19-17(20)12-7-10-11(8-13(12)18(21)22)16-14(15-10)6-9-4-2-1-3-5-9/h1-5,7-8H,6H2,(H,15,16)