3-(4-methylphenyl)sulfonyl-6-(2-phenylethynyl)-7-oxa-3-azabicyclo[4.1.0]heptane

Systemtic Name: 3-(4-methylphenyl)sulfonyl-6-(2-phenylethynyl)-7-oxa-3-azabicyclo[4.1.0]heptane Openeye Name: 6-(2-phenylethynyl)-3-(p-tolylsulfonyl)-7-oxa-3-azabicyclo[4.1.0]heptane CAS Name: 3-(4-methylphenyl)sulfonyl-6-(2-phenylethynyl)-7-oxa-3-azabicyclo[4.1.0]heptane IUPAC Name: 3-(4-methylphenyl)sulfonyl-6-(2-phenylethynyl)-7-oxa-3-azabicyclo[4.1.0]heptane Traditional Name: 6-(2-phenylethynyl)-3-tosyl-7-oxa-3-azabicyclo[4.1.0]heptane Formula: C20H19NO3S MolecularWeight: 353.43476

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCC3(C(C2)O3)C#CC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC3(C(C2)O3)C#CC4=CC=CC=C4

InChI

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