ethyl 7-[(1R,2S,3R,4R)-1,2,3,4,5-pentaacetyloxypentyl]-6,9-diaza-8-azoniaspiro[4.4]nona-6,8-diene-8-carboxylate

Systemtic Name: ethyl 7-[(1R,2S,3R,4R)-1,2,3,4,5-pentaacetyloxypentyl]-6,9-diaza-8-azoniaspiro[4.4]nona-6,8-diene-8-carboxylate Openeye Name: ethyl 7-[(1R,2S,3R,4R)-1,2,3,4,5-pentaacetoxypentyl]-6,9-diaza-8-azoniaspiro[4.4]nona-6,8-diene-8-carboxylate CAS Name: 7-[(1R,2S,3R,4R)-1,2,3,4,5-pentaacetyloxypentyl]-6,9-diaza-8-azoniaspiro[4.4]nona-6,8-diene-8-carboxylic acid ethyl ester IUPAC Name: ethyl 7-[(1R,2S,3R,4R)-1,2,3,4,5-pentaacetyloxypentyl]-6,9-diaza-8-azoniaspiro[4.4]nona-6,8-diene-8-carboxylate Traditional Name: 7-[(1R,2S,3R,4R)-1,2,3,4,5-pentaacetoxypentyl]-6,9-diaza-8-azoniaspiro[4.4]nona-6,8-diene-8-carboxylic acid ethyl ester Formula: C24H34N3O12+ MolecularWeight: 556.53966

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)[N+]1=NC2(CCCC2)N=C1C(C(C(C(COC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C

Isomeric SMILES

CCOC(=O)[N+]1=NC2(CCCC2)N=C1[C@H]([C@@H]([C@@H]([C@@H](COC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C

InChI

InChI=1S/C24H34N3O12/c1-7-34-23(33)27-22(25-24(26-27)10-8-9-11-24)21(39-17(6)32)20(38-16(5)31)19(37-15(4)30)18(36-14(3)29)12-35-13(2)28/h18-21H,7-12H2,1-6H3/q+1/t18-,19-,20-,21+/m1/s1