(1S,5S,6R)-6-phenyl-8-quinoxalin-2-yl-8-azabicyclo[3.2.1]oct-3-en-2-one

Systemtic Name: (1S,5S,6R)-6-phenyl-8-quinoxalin-2-yl-8-azabicyclo[3.2.1]oct-3-en-2-one Openeye Name: (1S,5S,6R)-6-phenyl-8-quinoxalin-2-yl-8-azabicyclo[3.2.1]oct-3-en-2-one CAS Name: (1S,5S,6R)-6-phenyl-8-(2-quinoxalinyl)-8-azabicyclo[3.2.1]oct-3-en-2-one IUPAC Name: (1S,5S,6R)-6-phenyl-8-quinoxalin-2-yl-8-azabicyclo[3.2.1]oct-3-en-2-one Traditional Name: (1S,5S,6R)-6-phenyl-8-quinoxalin-2-yl-8-azabicyclo[3.2.1]oct-3-en-2-one Formula: C21H17N3O MolecularWeight: 327.37918

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C2C=CC(=O)C1N2C3=NC4=CC=CC=C4N=C3)C5=CC=CC=C5

Isomeric SMILES

C1[C@@H]([C@@H]2C=CC(=O)[C@H]1N2C3=NC4=CC=CC=C4N=C3)C5=CC=CC=C5

InChI

InChI=1S/C21H17N3O/c25-20-11-10-18-15(14-6-2-1-3-7-14)12-19(20)24(18)21-13-22-16-8-4-5-9-17(16)23-21/h1-11,13,15,18-19H,12H2/t15-,18+,19+/m1/s1