(4S,5R)-4-methyl-5-(4-methylphenyl)sulfonyl-1-azabicyclo[3.3.1]nonan-2-one

Systemtic Name: (4S,5R)-4-methyl-5-(4-methylphenyl)sulfonyl-1-azabicyclo[3.3.1]nonan-2-one Openeye Name: (4S,5R)-4-methyl-5-(p-tolylsulfonyl)-1-azabicyclo[3.3.1]nonan-2-one CAS Name: (4S,5R)-4-methyl-5-(4-methylphenyl)sulfonyl-1-azabicyclo[3.3.1]nonan-2-one IUPAC Name: (4S,5R)-4-methyl-5-(4-methylphenyl)sulfonyl-1-azabicyclo[3.3.1]nonan-2-one Traditional Name: (4S,5R)-4-methyl-5-tosyl-1-azabicyclo[3.3.1]nonan-2-one Formula: C16H21NO3S MolecularWeight: 307.40784

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=O)N2CCCC1(C2)S(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

C[C@H]1CC(=O)N2CCC[C@@]1(C2)S(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C16H21NO3S/c1-12-4-6-14(7-5-12)21(19,20)16-8-3-9-17(11-16)15(18)10-13(16)2/h4-7,13H,3,8-11H2,1-2H3/t13-,16-/m0/s1