[2-[6-[2-(1H-imidazol-3-ium-3-ylcarbonyloxy)ethanoyloxy]hexoxy]-2-oxidanylidene-ethyl] imidazole-1-carboxylate

Systemtic Name: [2-[6-[2-(1H-imidazol-3-ium-3-ylcarbonyloxy)ethanoyloxy]hexoxy]-2-oxidanylidene-ethyl] imidazole-1-carboxylate Openeye Name: [2-[6-[2-(1H-imidazol-3-ium-3-carbonyloxy)acetyl]oxyhexoxy]-2-oxo-ethyl] imidazole-1-carboxylate CAS Name: 1-imidazolecarboxylic acid [2-[6-[2-[1H-imidazol-3-ium-3-yl(oxo)methoxy]-1-oxoethoxy]hexoxy]-2-oxoethyl] ester IUPAC Name: [2-[6-[2-(1H-imidazol-3-ium-3-carbonyloxy)acetyl]oxyhexoxy]-2-oxoethyl] imidazole-1-carboxylate Traditional Name: imidazole-1-carboxylic acid [2-[6-[2-(1H-imidazol-3-ium-3-carbonyloxy)acetyl]oxyhexoxy]-2-keto-ethyl] ester Formula: C18H23N4O8+ MolecularWeight: 423.39722

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Descriptors Computed from Structure

Canonical SMILES:

C1=C[N+](=CN1)C(=O)OCC(=O)OCCCCCCOC(=O)COC(=O)N2C=CN=C2

Isomeric SMILES

C1=C[N+](=CN1)C(=O)OCC(=O)OCCCCCCOC(=O)COC(=O)N2C=CN=C2

InChI

InChI=1S/C18H22N4O8/c23-15(11-29-17(25)21-7-5-19-13-21)27-9-3-1-2-4-10-28-16(24)12-30-18(26)22-8-6-20-14-22/h5-8,13-14H,1-4,9-12H2/p+1