ethyl 4-azanyl-10H-pyrimido[1,2-a]benzimidazol-5-ium-3-carboxylate

Systemtic Name: ethyl 4-azanyl-10H-pyrimido[1,2-a]benzimidazol-5-ium-3-carboxylate Openeye Name: ethyl 4-amino-10H-pyrimido[1,2-a]benzimidazol-5-ium-3-carboxylate CAS Name: 4-amino-10H-pyrimido[1,2-a]benzimidazol-5-ium-3-carboxylic acid ethyl ester IUPAC Name: ethyl 4-amino-10H-pyrimido[1,2-a]benzimidazol-5-ium-3-carboxylate Traditional Name: 4-amino-10H-pyrimido[1,2-a]benzimidazol-5-ium-3-carboxylic acid ethyl ester Formula: C13H13N4O2+ MolecularWeight: 257.26792

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C2NC3=CC=CC=C3[N+]2=C1N

Isomeric SMILES

CCOC(=O)C1=CN=C2NC3=CC=CC=C3[N+]2=C1N

InChI

InChI=1S/C13H12N4O2/c1-2-19-12(18)8-7-15-13-16-9-5-3-4-6-10(9)17(13)11(8)14/h3-7H,2H2,1H3,(H2,14,15,16,18)/p+1