ethyl (1S,5S,6R)-4-oxidanylidene-6-phenyl-3,7-diazabicyclo[3.2.2]nonane-7-carboxylate

Systemtic Name: ethyl (1S,5S,6R)-4-oxidanylidene-6-phenyl-3,7-diazabicyclo[3.2.2]nonane-7-carboxylate Openeye Name: ethyl (1S,5S,6R)-4-oxo-6-phenyl-3,7-diazabicyclo[3.2.2]nonane-7-carboxylate CAS Name: (1S,5S,6R)-4-oxo-6-phenyl-3,7-diazabicyclo[3.2.2]nonane-7-carboxylic acid ethyl ester IUPAC Name: ethyl (1S,5S,6R)-4-oxo-6-phenyl-3,7-diazabicyclo[3.2.2]nonane-7-carboxylate Traditional Name: (1S,5S,6R)-4-keto-6-phenyl-3,7-diazabicyclo[3.2.2]nonane-7-carboxylic acid ethyl ester Formula: C16H20N2O3 MolecularWeight: 288.3416

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1C2CCC(C1C3=CC=CC=C3)C(=O)NC2

Isomeric SMILES

CCOC(=O)N1[C@H]2CC[C@@H]([C@@H]1C3=CC=CC=C3)C(=O)NC2

InChI

InChI=1S/C16H20N2O3/c1-2-21-16(20)18-12-8-9-13(15(19)17-10-12)14(18)11-6-4-3-5-7-11/h3-7,12-14H,2,8-10H2,1H3,(H,17,19)/t12-,13-,14-/m0/s1