ethyl 3-[2-[2-(6-ethoxycarbonyl-3-ethyl-2-methyl-benzimidazol-3-ium-1-yl)ethoxy]ethyl]-1-ethyl-2-methyl-benzimidazol-1-ium-5-carboxylate

Systemtic Name: ethyl 3-[2-[2-(6-ethoxycarbonyl-3-ethyl-2-methyl-benzimidazol-3-ium-1-yl)ethoxy]ethyl]-1-ethyl-2-methyl-benzimidazol-1-ium-5-carboxylate Openeye Name: ethyl 3-[2-[2-(6-ethoxycarbonyl-3-ethyl-2-methyl-benzimidazol-3-ium-1-yl)ethoxy]ethyl]-1-ethyl-2-methyl-benzimidazol-1-ium-5-carboxylate CAS Name: 3-[2-[2-(6-ethoxycarbonyl-3-ethyl-2-methyl-1-benzimidazol-3-iumyl)ethoxy]ethyl]-1-ethyl-2-methyl-5-benzimidazol-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 3-[2-[2-(6-ethoxycarbonyl-3-ethyl-2-methylbenzimidazol-3-ium-1-yl)ethoxy]ethyl]-1-ethyl-2-methylbenzimidazol-1-ium-5-carboxylate Traditional Name: 3-[2-[2-(6-carbethoxy-3-ethyl-2-methyl-benzimidazol-3-ium-1-yl)ethoxy]ethyl]-1-ethyl-2-methyl-benzimidazol-1-ium-5-carboxylic acid ethyl ester Formula: C30H40N4O5+2 MolecularWeight: 536.6624

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=C(N(C2=C1C=CC(=C2)C(=O)OCC)CCOCCN3C(=[N+](C4=C3C=C(C=C4)C(=O)OCC)CC)C)C

Isomeric SMILES

CC[N+]1=C(N(C2=C1C=CC(=C2)C(=O)OCC)CCOCCN3C(=[N+](C4=C3C=C(C=C4)C(=O)OCC)CC)C)C

InChI

InChI=1S/C30H40N4O5/c1-7-31-21(5)33(27-19-23(11-13-25(27)31)29(35)38-9-3)15-17-37-18-16-34-22(6)32(8-2)26-14-12-24(20-28(26)34)30(36)39-10-4/h11-14,19-20H,7-10,15-18H2,1-6H3/q+2