2-[5-[azaniumylidene(azanyl)methyl]-2H-benzimidazol-1-ium-2-yl]-6-phenyl-phenolate

Systemtic Name: 2-[5-[azaniumylidene(azanyl)methyl]-2H-benzimidazol-1-ium-2-yl]-6-phenyl-phenolate Openeye Name: 2-[5-[amino(azaniumylidene)methyl]-2H-benzimidazol-1-ium-2-yl]-6-phenyl-phenolate CAS Name: 2-[5-[amino(iminio)methyl]-2H-benzimidazol-1-ium-2-yl]-6-phenylphenolate IUPAC Name: 2-[5-[amino(azaniumylidene)methyl]-2H-benzimidazol-1-ium-2-yl]-6-phenylphenolate Traditional Name: 2-[5-[amino(iminio)methyl]-2H-benzimidazol-1-ium-2-yl]-6-phenyl-phenolate Formula: C20H17N4O+ MolecularWeight: 329.37518

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C(=CC=C2)C3[NH+]=C4C=CC(=CC4=N3)C(=[NH2+])N)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C(=CC=C2)C3[NH+]=C4C=CC(=CC4=N3)C(=[NH2+])N)[O-]

InChI

InChI=1S/C20H16N4O/c21-19(22)13-9-10-16-17(11-13)24-20(23-16)15-8-4-7-14(18(15)25)12-5-2-1-3-6-12/h1-11,20,25H,(H3,21,22)/p+1