ethyl 1,3-bis(2-hydroxyethyl)-2-methyl-benzimidazol-1-ium-5-carboxylate

Systemtic Name: ethyl 1,3-bis(2-hydroxyethyl)-2-methyl-benzimidazol-1-ium-5-carboxylate Openeye Name: ethyl 1,3-bis(2-hydroxyethyl)-2-methyl-benzimidazol-1-ium-5-carboxylate CAS Name: 1,3-bis(2-hydroxyethyl)-2-methyl-5-benzimidazol-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 1,3-bis(2-hydroxyethyl)-2-methylbenzimidazol-1-ium-5-carboxylate Traditional Name: 1,3-bis(2-hydroxyethyl)-2-methyl-benzimidazol-1-ium-5-carboxylic acid ethyl ester Formula: C15H21N2O4+ MolecularWeight: 293.33824

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(C=C1)[N+](=C(N2CCO)C)CCO

Isomeric SMILES

CCOC(=O)C1=CC2=C(C=C1)[N+](=C(N2CCO)C)CCO

InChI

InChI=1S/C15H21N2O4/c1-3-21-15(20)12-4-5-13-14(10-12)17(7-9-19)11(2)16(13)6-8-18/h4-5,10,18-19H,3,6-9H2,1-2H3/q+1