ethyl (1R,2R,5S,6S)-2-acetyloxy-3-ethoxy-6-ethyl-5-phenyl-4-azabicyclo[3.2.0]hept-3-ene-1-carboxylate

Systemtic Name: ethyl (1R,2R,5S,6S)-2-acetyloxy-3-ethoxy-6-ethyl-5-phenyl-4-azabicyclo[3.2.0]hept-3-ene-1-carboxylate Openeye Name: ethyl (1R,2R,5S,6S)-2-acetoxy-3-ethoxy-6-ethyl-5-phenyl-4-azabicyclo[3.2.0]hept-3-ene-1-carboxylate CAS Name: (1R,2R,5S,6S)-2-acetyloxy-3-ethoxy-6-ethyl-5-phenyl-4-azabicyclo[3.2.0]hept-3-ene-1-carboxylic acid ethyl ester IUPAC Name: ethyl (1R,2R,5S,6S)-2-acetyloxy-3-ethoxy-6-ethyl-5-phenyl-4-azabicyclo[3.2.0]hept-3-ene-1-carboxylate Traditional Name: (1R,2R,5S,6S)-2-acetoxy-3-ethoxy-6-ethyl-5-phenyl-4-azabicyclo[3.2.0]hept-3-ene-1-carboxylic acid ethyl ester Formula: C21H27NO5 MolecularWeight: 373.44278

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CC2(C1(N=C(C2OC(=O)C)OCC)C3=CC=CC=C3)C(=O)OCC

Isomeric SMILES

CC[C@H]1C[C@]2([C@@]1(N=C([C@@H]2OC(=O)C)OCC)C3=CC=CC=C3)C(=O)OCC

InChI

InChI=1S/C21H27NO5/c1-5-15-13-20(19(24)26-7-3)17(27-14(4)23)18(25-6-2)22-21(15,20)16-11-9-8-10-12-16/h8-12,15,17H,5-7,13H2,1-4H3/t15-,17-,20+,21-/m0/s1