3H-benzimidazol-1-ium-1-yl-(4-chloranyl-3-nitro-phenyl)methanone

Systemtic Name: 3H-benzimidazol-1-ium-1-yl-(4-chloranyl-3-nitro-phenyl)methanone Openeye Name: 3H-benzimidazol-1-ium-1-yl-(4-chloro-3-nitro-phenyl)methanone CAS Name: 3H-benzimidazol-1-ium-1-yl-(4-chloro-3-nitrophenyl)methanone IUPAC Name: 3H-benzimidazol-1-ium-1-yl-(4-chloro-3-nitrophenyl)methanone Traditional Name: 3H-benzimidazol-1-ium-1-yl-(4-chloro-3-nitro-phenyl)methanone Formula: C14H9ClN3O3+ MolecularWeight: 302.69256

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC=[N+]2C(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)NC=[N+]2C(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C14H8ClN3O3/c15-10-6-5-9(7-13(10)18(20)21)14(19)17-8-16-11-3-1-2-4-12(11)17/h1-8H/p+1