ethyl 2-[4,7-bis(2-ethoxy-2-oxidanylidene-ethyl)-1,4,7-triazonan-1-yl]ethanoate

Systemtic Name: ethyl 2-[4,7-bis(2-ethoxy-2-oxidanylidene-ethyl)-1,4,7-triazonan-1-yl]ethanoate Openeye Name: ethyl 2-[4,7-bis(2-ethoxy-2-oxo-ethyl)-1,4,7-triazonan-1-yl]acetate CAS Name: 2-[4,7-bis(2-ethoxy-2-oxoethyl)-1,4,7-triazonan-1-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[4,7-bis(2-ethoxy-2-oxoethyl)-1,4,7-triazonan-1-yl]acetate Traditional Name: 2-[4,7-bis(2-ethoxy-2-keto-ethyl)-1,4,7-triazonan-1-yl]acetic acid ethyl ester Formula: C18H33N3O6 MolecularWeight: 387.47112

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1CCN(CCN(CC1)CC(=O)OCC)CC(=O)OCC

Isomeric SMILES

CCOC(=O)CN1CCN(CCN(CC1)CC(=O)OCC)CC(=O)OCC

InChI

InChI=1S/C18H33N3O6/c1-4-25-16(22)13-19-7-9-20(14-17(23)26-5-2)11-12-21(10-8-19)15-18(24)27-6-3/h4-15H2,1-3H3