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

Systemtic Name: ethyl (1R,5S,6S)-3-ethoxy-6-ethyl-2-oxidanylidene-5-phenyl-4-azabicyclo[3.2.0]hept-3-ene-1-carboxylate Openeye Name: ethyl (1R,5S,6S)-3-ethoxy-6-ethyl-2-oxo-5-phenyl-4-azabicyclo[3.2.0]hept-3-ene-1-carboxylate CAS Name: (1R,5S,6S)-3-ethoxy-6-ethyl-2-oxo-5-phenyl-4-azabicyclo[3.2.0]hept-3-ene-1-carboxylic acid ethyl ester IUPAC Name: ethyl (1R,5S,6S)-3-ethoxy-6-ethyl-2-oxo-5-phenyl-4-azabicyclo[3.2.0]hept-3-ene-1-carboxylate Traditional Name: (1R,5S,6S)-3-ethoxy-6-ethyl-2-keto-5-phenyl-4-azabicyclo[3.2.0]hept-3-ene-1-carboxylic acid ethyl ester Formula: C19H23NO4 MolecularWeight: 329.39022

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CC2(C1(N=C(C2=O)OCC)C3=CC=CC=C3)C(=O)OCC

Isomeric SMILES

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

InChI

InChI=1S/C19H23NO4/c1-4-13-12-18(17(22)24-6-3)15(21)16(23-5-2)20-19(13,18)14-10-8-7-9-11-14/h7-11,13H,4-6,12H2,1-3H3/t13-,18+,19-/m0/s1