6,7-dimethylidene-3-(4-methylphenyl)sulfonyl-5-phenyl-3-azabicyclo[3.1.1]heptane

Systemtic Name: 6,7-dimethylidene-3-(4-methylphenyl)sulfonyl-5-phenyl-3-azabicyclo[3.1.1]heptane Openeye Name: 6,7-dimethylene-5-phenyl-3-(p-tolylsulfonyl)-3-azabicyclo[3.1.1]heptane CAS Name: 6,7-dimethylene-3-(4-methylphenyl)sulfonyl-5-phenyl-3-azabicyclo[3.1.1]heptane IUPAC Name: 6,7-dimethylidene-3-(4-methylphenyl)sulfonyl-5-phenyl-3-azabicyclo[3.1.1]heptane Traditional Name: 6,7-dimethylene-5-phenyl-3-tosyl-3-azabicyclo[3.1.1]heptane Formula: C21H21NO2S MolecularWeight: 351.46194

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CC3C(=C)C(C2)(C3=C)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CC3C(=C)C(C2)(C3=C)C4=CC=CC=C4

InChI

InChI=1S/C21H21NO2S/c1-15-9-11-19(12-10-15)25(23,24)22-13-20-16(2)21(14-22,17(20)3)18-7-5-4-6-8-18/h4-12,20H,2-3,13-14H2,1H3