ethyl 1-ethyl-2-methyl-3-[2-oxidanylidene-2-[(2,4,6-trimethylphenyl)amino]ethyl]benzimidazol-1-ium-5-carboxylate

Systemtic Name: ethyl 1-ethyl-2-methyl-3-[2-oxidanylidene-2-[(2,4,6-trimethylphenyl)amino]ethyl]benzimidazol-1-ium-5-carboxylate Openeye Name: ethyl 1-ethyl-2-methyl-3-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]benzimidazol-1-ium-5-carboxylate CAS Name: 1-ethyl-2-methyl-3-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]-5-benzimidazol-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 1-ethyl-2-methyl-3-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]benzimidazol-1-ium-5-carboxylate Traditional Name: 1-ethyl-3-(2-keto-2-mesidino-ethyl)-2-methyl-benzimidazol-1-ium-5-carboxylic acid ethyl ester Formula: C24H30N3O3+ MolecularWeight: 408.5133

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=C(N(C2=C1C=CC(=C2)C(=O)OCC)CC(=O)NC3=C(C=C(C=C3C)C)C)C

Isomeric SMILES

CC[N+]1=C(N(C2=C1C=CC(=C2)C(=O)OCC)CC(=O)NC3=C(C=C(C=C3C)C)C)C

InChI

InChI=1S/C24H29N3O3/c1-7-26-18(6)27(21-13-19(9-10-20(21)26)24(29)30-8-2)14-22(28)25-23-16(4)11-15(3)12-17(23)5/h9-13H,7-8,14H2,1-6H3/p+1