ethyl 3-[(5-ethanoyl-2-methoxy-phenyl)methyl]-1-ethyl-2-methyl-benzimidazol-1-ium-5-carboxylate

Systemtic Name: ethyl 3-[(5-ethanoyl-2-methoxy-phenyl)methyl]-1-ethyl-2-methyl-benzimidazol-1-ium-5-carboxylate Openeye Name: ethyl 3-[(5-acetyl-2-methoxy-phenyl)methyl]-1-ethyl-2-methyl-benzimidazol-1-ium-5-carboxylate CAS Name: 3-[(5-acetyl-2-methoxyphenyl)methyl]-1-ethyl-2-methyl-5-benzimidazol-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 3-[(5-acetyl-2-methoxyphenyl)methyl]-1-ethyl-2-methylbenzimidazol-1-ium-5-carboxylate Traditional Name: 3-(5-acetyl-2-methoxy-benzyl)-1-ethyl-2-methyl-benzimidazol-1-ium-5-carboxylic acid ethyl ester Formula: C23H27N2O4+ MolecularWeight: 395.47148

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=C(N(C2=C1C=CC(=C2)C(=O)OCC)CC3=C(C=CC(=C3)C(=O)C)OC)C

Isomeric SMILES

CC[N+]1=C(N(C2=C1C=CC(=C2)C(=O)OCC)CC3=C(C=CC(=C3)C(=O)C)OC)C

InChI

InChI=1S/C23H27N2O4/c1-6-24-16(4)25(14-19-12-17(15(3)26)9-11-22(19)28-5)21-13-18(8-10-20(21)24)23(27)29-7-2/h8-13H,6-7,14H2,1-5H3/q+1