2-[[1-(4-methoxyphenyl)benzimidazol-5-yl]iminomethyl]-6-nitro-phenolate

Systemtic Name: 2-[[1-(4-methoxyphenyl)benzimidazol-5-yl]iminomethyl]-6-nitro-phenolate Openeye Name: 2-[[1-(4-methoxyphenyl)benzimidazol-5-yl]iminomethyl]-6-nitro-phenolate CAS Name: 2-[[1-(4-methoxyphenyl)-5-benzimidazolyl]iminomethyl]-6-nitrophenolate IUPAC Name: 2-[[1-(4-methoxyphenyl)benzimidazol-5-yl]iminomethyl]-6-nitrophenolate Traditional Name: 2-[[1-(4-methoxyphenyl)benzimidazol-5-yl]iminomethyl]-6-nitro-phenolate Formula: C21H15N4O4- MolecularWeight: 387.3682

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C=NC3=C2C=CC(=C3)N=CC4=C(C(=CC=C4)[N+](=O)[O-])[O-]

Isomeric SMILES

COC1=CC=C(C=C1)N2C=NC3=C2C=CC(=C3)N=CC4=C(C(=CC=C4)[N+](=O)[O-])[O-]

InChI

InChI=1S/C21H16N4O4/c1-29-17-8-6-16(7-9-17)24-13-23-18-11-15(5-10-19(18)24)22-12-14-3-2-4-20(21(14)26)25(27)28/h2-13,26H,1H3/p-1