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

Systemtic Name: 2-nitro-6-[[1-(phenylmethyl)benzimidazol-2-yl]iminomethyl]phenolate Openeye Name: 2-[(1-benzylbenzimidazol-2-yl)iminomethyl]-6-nitro-phenolate CAS Name: 2-nitro-6-[[1-(phenylmethyl)-2-benzimidazolyl]iminomethyl]phenolate IUPAC Name: 2-[(1-benzylbenzimidazol-2-yl)iminomethyl]-6-nitrophenolate Traditional Name: 2-[(1-benzylbenzimidazol-2-yl)iminomethyl]-6-nitro-phenolate Formula: C21H15N4O3- MolecularWeight: 371.3688

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C3=CC=CC=C3N=C2N=CC4=C(C(=CC=C4)[N+](=O)[O-])[O-]

Isomeric SMILES

C1=CC=C(C=C1)CN2C3=CC=CC=C3N=C2N=CC4=C(C(=CC=C4)[N+](=O)[O-])[O-]

InChI

InChI=1S/C21H16N4O3/c26-20-16(9-6-12-19(20)25(27)28)13-22-21-23-17-10-4-5-11-18(17)24(21)14-15-7-2-1-3-8-15/h1-13,26H,14H2/p-1