2-[[cyano-(5-methylbenzimidazol-1-id-2-yl)methylidene]amino]-4-nitro-phenolate

Systemtic Name: 2-[[cyano-(5-methylbenzimidazol-1-id-2-yl)methylidene]amino]-4-nitro-phenolate Openeye Name: 2-[[cyano-(5-methylbenzimidazol-1-id-2-yl)methylene]amino]-4-nitro-phenolate CAS Name: 2-[[cyano-(5-methyl-2-benzimidazol-1-idyl)methylidene]amino]-4-nitrophenolate IUPAC Name: 2-[[cyano-(5-methylbenzimidazol-1-id-2-yl)methylidene]amino]-4-nitrophenolate Traditional Name: 2-[[cyano-(5-methylbenzimidazol-1-id-2-yl)methylene]amino]-4-nitro-phenolate Formula: C16H9N5O3-2 MolecularWeight: 319.27436

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)[N-]C(=N2)C(=NC3=C(C=CC(=C3)[N+](=O)[O-])[O-])C#N

Isomeric SMILES

CC1=CC2=C(C=C1)[N-]C(=N2)C(=NC3=C(C=CC(=C3)[N+](=O)[O-])[O-])C#N

InChI

InChI=1S/C16H10N5O3/c1-9-2-4-11-12(6-9)20-16(19-11)14(8-17)18-13-7-10(21(23)24)3-5-15(13)22/h2-7H,1H3,(H-,18,19,20,22)/q-1/p-1