2-[5-[azaniumylidene(azanyl)methyl]-2H-benzimidazol-1-ium-2-yl]pyridin-3-olate

Systemtic Name: 2-[5-[azaniumylidene(azanyl)methyl]-2H-benzimidazol-1-ium-2-yl]pyridin-3-olate Openeye Name: 2-[5-[amino(azaniumylidene)methyl]-2H-benzimidazol-1-ium-2-yl]pyridin-3-olate CAS Name: 2-[5-[amino(iminio)methyl]-2H-benzimidazol-1-ium-2-yl]-3-pyridinolate IUPAC Name: 2-[5-[amino(azaniumylidene)methyl]-2H-benzimidazol-1-ium-2-yl]pyridin-3-olate Traditional Name: 2-[5-[amino(iminio)methyl]-2H-benzimidazol-1-ium-2-yl]pyridin-3-olate Formula: C13H12N5O+ MolecularWeight: 254.26728

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(N=C1)C2[NH+]=C3C=CC(=CC3=N2)C(=[NH2+])N)[O-]

Isomeric SMILES

C1=CC(=C(N=C1)C2[NH+]=C3C=CC(=CC3=N2)C(=[NH2+])N)[O-]

InChI

InChI=1S/C13H11N5O/c14-12(15)7-3-4-8-9(6-7)18-13(17-8)11-10(19)2-1-5-16-11/h1-6,13,19H,(H3,14,15)/p+1