2-(4-methylphenyl)sulfonyl-2-azabicyclo[2.2.1]heptane-5-carboxylic acid

Systemtic Name: 2-(4-methylphenyl)sulfonyl-2-azabicyclo[2.2.1]heptane-5-carboxylic acid Openeye Name: 2-(p-tolylsulfonyl)-2-azabicyclo[2.2.1]heptane-5-carboxylic acid CAS Name: 2-(4-methylphenyl)sulfonyl-2-azabicyclo[2.2.1]heptane-5-carboxylic acid IUPAC Name: 2-(4-methylphenyl)sulfonyl-2-azabicyclo[2.2.1]heptane-5-carboxylic acid Traditional Name: 2-tosyl-2-azabicyclo[2.2.1]heptane-5-carboxylic acid Formula: C14H17NO4S MolecularWeight: 295.35408

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CC3CC2CC3C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CC3CC2CC3C(=O)O

InChI

InChI=1S/C14H17NO4S/c1-9-2-4-12(5-3-9)20(18,19)15-8-10-6-11(15)7-13(10)14(16)17/h2-5,10-11,13H,6-8H2,1H3,(H,16,17)