tert-butyl (1R,5S)-3-(4-methylphenyl)sulfonyl-8-azabicyclo[3.2.1]oct-3-ene-8-carboxylate

Systemtic Name: tert-butyl (1R,5S)-3-(4-methylphenyl)sulfonyl-8-azabicyclo[3.2.1]oct-3-ene-8-carboxylate Openeye Name: tert-butyl (1R,5S)-3-(p-tolylsulfonyl)-8-azabicyclo[3.2.1]oct-3-ene-8-carboxylate CAS Name: (1R,5S)-3-(4-methylphenyl)sulfonyl-8-azabicyclo[3.2.1]oct-3-ene-8-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl (1R,5S)-3-(4-methylphenyl)sulfonyl-8-azabicyclo[3.2.1]oct-3-ene-8-carboxylate Traditional Name: (1R,5S)-3-tosyl-8-azabicyclo[3.2.1]oct-3-ene-8-carboxylic acid tert-butyl ester Formula: C19H25NO4S MolecularWeight: 363.4711

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C2=CC3CCC(C2)N3C(=O)OC(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2=C[C@@H]3CC[C@H](C2)N3C(=O)OC(C)(C)C

InChI

InChI=1S/C19H25NO4S/c1-13-5-9-16(10-6-13)25(22,23)17-11-14-7-8-15(12-17)20(14)18(21)24-19(2,3)4/h5-6,9-11,14-15H,7-8,12H2,1-4H3/t14-,15+/m0/s1