ethyl 2-methyl-4-(2-piperidin-1-ium-1-ylethyl)imidazo[1,2-a]benzimidazole-1-carboxylate

Systemtic Name: ethyl 2-methyl-4-(2-piperidin-1-ium-1-ylethyl)imidazo[1,2-a]benzimidazole-1-carboxylate Openeye Name: ethyl 2-methyl-4-(2-piperidin-1-ium-1-ylethyl)imidazo[1,2-a]benzimidazole-1-carboxylate CAS Name: 2-methyl-4-[2-(1-piperidin-1-iumyl)ethyl]-1-imidazo[1,2-a]benzimidazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-methyl-4-(2-piperidin-1-ium-1-ylethyl)imidazo[1,2-a]benzimidazole-1-carboxylate Traditional Name: 2-methyl-4-(2-piperidin-1-ium-1-ylethyl)imidazo[1,2-a]benzimidazole-1-carboxylic acid ethyl ester Formula: C20H27N4O2+ MolecularWeight: 355.45398

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C2N1C3=CC=CC=C3N2CC[NH+]4CCCCC4)C

Isomeric SMILES

CCOC(=O)C1=C(N=C2N1C3=CC=CC=C3N2CC[NH+]4CCCCC4)C

InChI

InChI=1S/C20H26N4O2/c1-3-26-19(25)18-15(2)21-20-23(14-13-22-11-7-4-8-12-22)16-9-5-6-10-17(16)24(18)20/h5-6,9-10H,3-4,7-8,11-14H2,1-2H3/p+1