ethyl 2-methyl-4-propyl-3H-imidazo[1,2-a]benzimidazol-4-ium-1-carboxylate chloride

Systemtic Name: ethyl 2-methyl-4-propyl-3H-imidazo[1,2-a]benzimidazol-4-ium-1-carboxylate chloride Openeye Name: ethyl 2-methyl-4-propyl-3H-imidazo[1,2-a]benzimidazol-4-ium-1-carboxylate chloride CAS Name: 2-methyl-4-propyl-3H-imidazo[1,2-a]benzimidazol-4-ium-1-carboxylic acid ethyl ester chloride IUPAC Name: ethyl 2-methyl-4-propyl-3H-imidazo[1,2-a]benzimidazol-4-ium-1-carboxylate chloride Traditional Name: 2-methyl-4-propyl-3H-imidazo[1,2-a]benzimidazol-4-ium-1-carboxylic acid ethyl ester chloride Formula: C16H20ClN3O2 MolecularWeight: 321.8019

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Descriptors Computed from Structure

Canonical SMILES:

CCC[N+]1=C2NC(=C(N2C3=CC=CC=C31)C(=O)OCC)C.[Cl-]

Isomeric SMILES

CCC[N+]1=C2NC(=C(N2C3=CC=CC=C31)C(=O)OCC)C.[Cl-]

InChI

InChI=1S/C16H19N3O2.ClH/c1-4-10-18-12-8-6-7-9-13(12)19-14(15(20)21-5-2)11(3)17-16(18)19;/h6-9H,4-5,10H2,1-3H3;1H