(1R,8S)-3-(4-methylphenyl)sulfonyl-8-phenyl-3-azabicyclo[4.2.0]oct-5-en-2-one

Systemtic Name: (1R,8S)-3-(4-methylphenyl)sulfonyl-8-phenyl-3-azabicyclo[4.2.0]oct-5-en-2-one Openeye Name: (1R,8S)-8-phenyl-3-(p-tolylsulfonyl)-3-azabicyclo[4.2.0]oct-5-en-2-one CAS Name: (1R,8S)-3-(4-methylphenyl)sulfonyl-8-phenyl-3-azabicyclo[4.2.0]oct-5-en-2-one IUPAC Name: (1R,8S)-3-(4-methylphenyl)sulfonyl-8-phenyl-3-azabicyclo[4.2.0]oct-5-en-2-one Traditional Name: (1R,8S)-8-phenyl-3-tosyl-3-azabicyclo[4.2.0]oct-5-en-2-one Formula: C20H19NO3S MolecularWeight: 353.43476

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CC=C3CC(C3C2=O)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CC=C3C[C@@H]([C@H]3C2=O)C4=CC=CC=C4

InChI

InChI=1S/C20H19NO3S/c1-14-7-9-17(10-8-14)25(23,24)21-12-11-16-13-18(19(16)20(21)22)15-5-3-2-4-6-15/h2-11,18-19H,12-13H2,1H3/t18-,19+/m1/s1