6-chloranyl-2-[(E)-2-(4-methyl-3-nitro-phenyl)ethenyl]-1H-benzimidazole

Systemtic Name: 6-chloranyl-2-[(E)-2-(4-methyl-3-nitro-phenyl)ethenyl]-1H-benzimidazole Openeye Name: 6-chloro-2-[(E)-2-(4-methyl-3-nitro-phenyl)vinyl]-1H-benzimidazole CAS Name: 6-chloro-2-[(E)-2-(4-methyl-3-nitrophenyl)ethenyl]-1H-benzimidazole IUPAC Name: 6-chloro-2-[(E)-2-(4-methyl-3-nitrophenyl)ethenyl]-1H-benzimidazole Traditional Name: 6-chloro-2-[(E)-2-(4-methyl-3-nitro-phenyl)vinyl]-1H-benzimidazole Formula: C16H12ClN3O2 MolecularWeight: 313.73838

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C=CC2=NC3=C(N2)C=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)/C=C/C2=NC3=C(N2)C=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C16H12ClN3O2/c1-10-2-3-11(8-15(10)20(21)22)4-7-16-18-13-6-5-12(17)9-14(13)19-16/h2-9H,1H3,(H,18,19)/b7-4+