methyl (1S,4S,5S)-3-oxidanylidene-4-phenyl-8-azabicyclo[3.2.1]oct-6-ene-8-carboxylate

Systemtic Name: methyl (1S,4S,5S)-3-oxidanylidene-4-phenyl-8-azabicyclo[3.2.1]oct-6-ene-8-carboxylate Openeye Name: methyl (1S,4S,5S)-3-oxo-4-phenyl-8-azabicyclo[3.2.1]oct-6-ene-8-carboxylate CAS Name: (1S,4S,5S)-3-oxo-4-phenyl-8-azabicyclo[3.2.1]oct-6-ene-8-carboxylic acid methyl ester IUPAC Name: methyl (1S,4S,5S)-3-oxo-4-phenyl-8-azabicyclo[3.2.1]oct-6-ene-8-carboxylate Traditional Name: (1S,4S,5S)-3-keto-4-phenyl-8-azabicyclo[3.2.1]oct-6-ene-8-carboxylic acid methyl ester Formula: C15H15NO3 MolecularWeight: 257.2845

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)N1C2CC(=O)C(C1C=C2)C3=CC=CC=C3

Isomeric SMILES

COC(=O)N1[C@H]2CC(=O)[C@H]([C@@H]1C=C2)C3=CC=CC=C3

InChI

InChI=1S/C15H15NO3/c1-19-15(18)16-11-7-8-12(16)14(13(17)9-11)10-5-3-2-4-6-10/h2-8,11-12,14H,9H2,1H3/t11-,12+,14+/m1/s1