(phenylmethyl) 6-(4-methylphenyl)sulfonyl-6-azabicyclo[3.1.0]hexane-3-carboxylate

Systemtic Name: (phenylmethyl) 6-(4-methylphenyl)sulfonyl-6-azabicyclo[3.1.0]hexane-3-carboxylate Openeye Name: benzyl 6-(p-tolylsulfonyl)-6-azabicyclo[3.1.0]hexane-3-carboxylate CAS Name: 6-(4-methylphenyl)sulfonyl-6-azabicyclo[3.1.0]hexane-3-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 6-(4-methylphenyl)sulfonyl-6-azabicyclo[3.1.0]hexane-3-carboxylate Traditional Name: 6-tosyl-6-azabicyclo[3.1.0]hexane-3-carboxylic acid benzyl ester Formula: C20H21NO4S MolecularWeight: 371.45004

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C3C2CC(C3)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C3C2CC(C3)C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C20H21NO4S/c1-14-7-9-17(10-8-14)26(23,24)21-18-11-16(12-19(18)21)20(22)25-13-15-5-3-2-4-6-15/h2-10,16,18-19H,11-13H2,1H3