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

Systemtic Name: methyl 1,3-bis(2-hydroxyethyl)-2-methyl-benzimidazol-1-ium-5-carboxylate Openeye Name: methyl 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 methyl ester IUPAC Name: methyl 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 methyl ester Formula: C14H19N2O4+ MolecularWeight: 279.31166

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C2=C(N1CCO)C=C(C=C2)C(=O)OC)CCO

Isomeric SMILES

CC1=[N+](C2=C(N1CCO)C=C(C=C2)C(=O)OC)CCO

InChI

InChI=1S/C14H19N2O4/c1-10-15(5-7-17)12-4-3-11(14(19)20-2)9-13(12)16(10)6-8-18/h3-4,9,17-18H,5-8H2,1-2H3/q+1