ethyl 2-[2,3-bis(azanyl)benzimidazol-1-ium-1-yl]ethanoate

Systemtic Name: ethyl 2-[2,3-bis(azanyl)benzimidazol-1-ium-1-yl]ethanoate Openeye Name: ethyl 2-(2,3-diaminobenzimidazol-1-ium-1-yl)acetate CAS Name: 2-(2,3-diamino-1-benzimidazol-1-iumyl)acetic acid ethyl ester IUPAC Name: ethyl 2-(2,3-diaminobenzimidazol-1-ium-1-yl)acetate Traditional Name: 2-(2,3-diaminobenzimidazol-1-ium-1-yl)acetic acid ethyl ester Formula: C11H15N4O2+ MolecularWeight: 235.2624

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C[N+]1=C(N(C2=CC=CC=C21)N)N

Isomeric SMILES

CCOC(=O)C[N+]1=C(N(C2=CC=CC=C21)N)N

InChI

InChI=1S/C11H14N4O2/c1-2-17-10(16)7-14-8-5-3-4-6-9(8)15(13)11(14)12/h3-6,12H,2,7,13H2,1H3/p+1