2-[[5-(1H-benzimidazol-2-yl)-2-methyl-phenyl]iminomethyl]-6-methyl-4-nitro-phenolate

Systemtic Name: 2-[[5-(1H-benzimidazol-2-yl)-2-methyl-phenyl]iminomethyl]-6-methyl-4-nitro-phenolate Openeye Name: 2-[[5-(1H-benzimidazol-2-yl)-2-methyl-phenyl]iminomethyl]-6-methyl-4-nitro-phenolate CAS Name: 2-[[5-(1H-benzimidazol-2-yl)-2-methylphenyl]iminomethyl]-6-methyl-4-nitrophenolate IUPAC Name: 2-[[5-(1H-benzimidazol-2-yl)-2-methylphenyl]iminomethyl]-6-methyl-4-nitrophenolate Traditional Name: 2-[[5-(1H-benzimidazol-2-yl)-2-methyl-phenyl]iminomethyl]-6-methyl-4-nitro-phenolate Formula: C22H17N4O3- MolecularWeight: 385.39538

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NC3=CC=CC=C3N2)N=CC4=CC(=CC(=C4[O-])C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NC3=CC=CC=C3N2)N=CC4=CC(=CC(=C4[O-])C)[N+](=O)[O-]

InChI

InChI=1S/C22H18N4O3/c1-13-7-8-15(22-24-18-5-3-4-6-19(18)25-22)11-20(13)23-12-16-10-17(26(28)29)9-14(2)21(16)27/h3-12,27H,1-2H3,(H,24,25)/p-1