2-[[2-methyl-1-(phenylmethyl)benzimidazol-5-yl]iminomethyl]-6-nitro-phenolate

Systemtic Name: 2-[[2-methyl-1-(phenylmethyl)benzimidazol-5-yl]iminomethyl]-6-nitro-phenolate Openeye Name: 2-[(1-benzyl-2-methyl-benzimidazol-5-yl)iminomethyl]-6-nitro-phenolate CAS Name: 2-[[2-methyl-1-(phenylmethyl)-5-benzimidazolyl]iminomethyl]-6-nitrophenolate IUPAC Name: 2-[(1-benzyl-2-methylbenzimidazol-5-yl)iminomethyl]-6-nitrophenolate Traditional Name: 2-[(1-benzyl-2-methyl-benzimidazol-5-yl)iminomethyl]-6-nitro-phenolate Formula: C22H17N4O3- MolecularWeight: 385.39538

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(N1CC3=CC=CC=C3)C=CC(=C2)N=CC4=C(C(=CC=C4)[N+](=O)[O-])[O-]

Isomeric SMILES

CC1=NC2=C(N1CC3=CC=CC=C3)C=CC(=C2)N=CC4=C(C(=CC=C4)[N+](=O)[O-])[O-]

InChI

InChI=1S/C22H18N4O3/c1-15-24-19-12-18(23-13-17-8-5-9-21(22(17)27)26(28)29)10-11-20(19)25(15)14-16-6-3-2-4-7-16/h2-13,27H,14H2,1H3/p-1