2-[(6-bromanyl-1-methyl-benzimidazol-2-yl)iminomethyl]-4-methyl-6-nitro-phenolate

Systemtic Name: 2-[(6-bromanyl-1-methyl-benzimidazol-2-yl)iminomethyl]-4-methyl-6-nitro-phenolate Openeye Name: 2-[(6-bromo-1-methyl-benzimidazol-2-yl)iminomethyl]-4-methyl-6-nitro-phenolate CAS Name: 2-[(6-bromo-1-methyl-2-benzimidazolyl)iminomethyl]-4-methyl-6-nitrophenolate IUPAC Name: 2-[(6-bromo-1-methylbenzimidazol-2-yl)iminomethyl]-4-methyl-6-nitrophenolate Traditional Name: 2-[(6-bromo-1-methyl-benzimidazol-2-yl)iminomethyl]-4-methyl-6-nitro-phenolate Formula: C16H12BrN4O3- MolecularWeight: 388.19548

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C=NC2=NC3=C(N2C)C=C(C=C3)Br)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C(=C1)C=NC2=NC3=C(N2C)C=C(C=C3)Br)[O-])[N+](=O)[O-]

InChI

InChI=1S/C16H13BrN4O3/c1-9-5-10(15(22)14(6-9)21(23)24)8-18-16-19-12-4-3-11(17)7-13(12)20(16)2/h3-8,22H,1-2H3/p-1