ethyl (1S,5S,6S)-5-chloranyl-4-oxidanylidene-3-(phenylcarbonyl)-3-azabicyclo[3.1.0]hexane-6-carboxylate

Systemtic Name: ethyl (1S,5S,6S)-5-chloranyl-4-oxidanylidene-3-(phenylcarbonyl)-3-azabicyclo[3.1.0]hexane-6-carboxylate Openeye Name: ethyl (1S,5S,6S)-3-benzoyl-5-chloro-4-oxo-3-azabicyclo[3.1.0]hexane-6-carboxylate CAS Name: (1S,5S,6S)-3-benzoyl-5-chloro-4-oxo-3-azabicyclo[3.1.0]hexane-6-carboxylic acid ethyl ester IUPAC Name: ethyl (1S,5S,6S)-3-benzoyl-5-chloro-4-oxo-3-azabicyclo[3.1.0]hexane-6-carboxylate Traditional Name: (1S,5S,6S)-3-benzoyl-5-chloro-4-keto-3-azabicyclo[3.1.0]hexane-6-carboxylic acid ethyl ester Formula: C15H14ClNO4 MolecularWeight: 307.72896

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C2C1(C(=O)N(C2)C(=O)C3=CC=CC=C3)Cl

Isomeric SMILES

CCOC(=O)[C@@H]1[C@@H]2[C@]1(C(=O)N(C2)C(=O)C3=CC=CC=C3)Cl

InChI

InChI=1S/C15H14ClNO4/c1-2-21-13(19)11-10-8-17(14(20)15(10,11)16)12(18)9-6-4-3-5-7-9/h3-7,10-11H,2,8H2,1H3/t10-,11+,15+/m1/s1