2-[(Z)-(5,6-dimethylbenzimidazol-1-yl)iminomethyl]-4-nitro-phenolate

Systemtic Name: 2-[(Z)-(5,6-dimethylbenzimidazol-1-yl)iminomethyl]-4-nitro-phenolate Openeye Name: 2-[(Z)-(5,6-dimethylbenzimidazol-1-yl)iminomethyl]-4-nitro-phenolate CAS Name: 2-[(Z)-(5,6-dimethyl-1-benzimidazolyl)iminomethyl]-4-nitrophenolate IUPAC Name: 2-[(Z)-(5,6-dimethylbenzimidazol-1-yl)iminomethyl]-4-nitrophenolate Traditional Name: 2-[(Z)-(5,6-dimethylbenzimidazol-1-yl)iminomethyl]-4-nitro-phenolate Formula: C16H13N4O3- MolecularWeight: 309.29942

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)N(C=N2)N=CC3=C(C=CC(=C3)[N+](=O)[O-])[O-]

Isomeric SMILES

CC1=CC2=C(C=C1C)N(C=N2)/N=C\C3=C(C=CC(=C3)[N+](=O)[O-])[O-]

InChI

InChI=1S/C16H14N4O3/c1-10-5-14-15(6-11(10)2)19(9-17-14)18-8-12-7-13(20(22)23)3-4-16(12)21/h3-9,21H,1-2H3/p-1/b18-8-