diethyl (1R,5S)-2-octyl-4-oxidanylidene-6,7-diazabicyclo[3.2.2]nonane-6,7-dicarboxylate

Systemtic Name: diethyl (1R,5S)-2-octyl-4-oxidanylidene-6,7-diazabicyclo[3.2.2]nonane-6,7-dicarboxylate Openeye Name: diethyl (1R,5S)-2-octyl-4-oxo-6,7-diazabicyclo[3.2.2]nonane-6,7-dicarboxylate CAS Name: (1R,5S)-2-octyl-4-oxo-6,7-diazabicyclo[3.2.2]nonane-6,7-dicarboxylic acid diethyl ester IUPAC Name: diethyl (1R,5S)-2-octyl-4-oxo-6,7-diazabicyclo[3.2.2]nonane-6,7-dicarboxylate Traditional Name: (1R,5S)-4-keto-2-octyl-6,7-diazabicyclo[3.2.2]nonane-6,7-dicarboxylic acid diethyl ester Formula: C21H36N2O5 MolecularWeight: 396.52094

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1CC(=O)C2CCC1N(N2C(=O)OCC)C(=O)OCC

Isomeric SMILES

CCCCCCCCC1CC(=O)[C@@H]2CC[C@H]1N(N2C(=O)OCC)C(=O)OCC

InChI

InChI=1S/C21H36N2O5/c1-4-7-8-9-10-11-12-16-15-19(24)18-14-13-17(16)22(20(25)27-5-2)23(18)21(26)28-6-3/h16-18H,4-15H2,1-3H3/t16?,17-,18+/m1/s1