ethyl (3aS)-2-methyl-4-(2-morpholin-4-ylethyl)-3,3a-dihydro-2H-imidazo[1,2-a]benzimidazol-9-ium-1-carboxylate

Systemtic Name: ethyl (3aS)-2-methyl-4-(2-morpholin-4-ylethyl)-3,3a-dihydro-2H-imidazo[1,2-a]benzimidazol-9-ium-1-carboxylate Openeye Name: ethyl (3aS)-2-methyl-4-(2-morpholinoethyl)-3,3a-dihydro-2H-imidazo[1,2-a]benzimidazol-9-ium-1-carboxylate CAS Name: (3aS)-2-methyl-4-[2-(4-morpholinyl)ethyl]-3,3a-dihydro-2H-imidazo[1,2-a]benzimidazol-9-ium-1-carboxylic acid ethyl ester IUPAC Name: ethyl (3aS)-2-methyl-4-(2-morpholin-4-ylethyl)-3,3a-dihydro-2H-imidazo[1,2-a]benzimidazol-9-ium-1-carboxylate Traditional Name: (3aS)-2-methyl-4-(2-morpholinoethyl)-3,3a-dihydro-2H-imidazo[1,2-a]benzimidazol-9-ium-1-carboxylic acid ethyl ester Formula: C19H27N4O3+ MolecularWeight: 359.44268

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=[N+]2C(NC1C)N(C3=CC=CC=C32)CCN4CCOCC4

Isomeric SMILES

CCOC(=O)C1=[N+]2[C@@H](NC1C)N(C3=CC=CC=C32)CCN4CCOCC4

InChI

InChI=1S/C19H27N4O3/c1-3-26-18(24)17-14(2)20-19-22(9-8-21-10-12-25-13-11-21)15-6-4-5-7-16(15)23(17)19/h4-7,14,19-20H,3,8-13H2,1-2H3/q+1/t14?,19-/m0/s1