3-(phenylmethyl)-6-(phenylsulfonyl)-3-azabicyclo[2.2.2]oct-5-ene-2,8-dione

Systemtic Name: 3-(phenylmethyl)-6-(phenylsulfonyl)-3-azabicyclo[2.2.2]oct-5-ene-2,8-dione Openeye Name: 6-(benzenesulfonyl)-3-benzyl-3-azabicyclo[2.2.2]oct-5-ene-2,8-dione CAS Name: 6-(benzenesulfonyl)-3-(phenylmethyl)-3-azabicyclo[2.2.2]oct-5-ene-2,8-dione IUPAC Name: 6-(benzenesulfonyl)-3-benzyl-3-azabicyclo[2.2.2]oct-5-ene-2,8-dione Traditional Name: 3-benzyl-6-besyl-3-azabicyclo[2.2.2]oct-5-ene-2,8-quinone Formula: C20H17NO4S MolecularWeight: 367.41828

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Descriptors Computed from Structure

Canonical SMILES:

C1C2C(=CC(C1=O)N(C2=O)CC3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1C2C(=CC(C1=O)N(C2=O)CC3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C20H17NO4S/c22-18-11-16-19(26(24,25)15-9-5-2-6-10-15)12-17(18)21(20(16)23)13-14-7-3-1-4-8-14/h1-10,12,16-17H,11,13H2