[1-[[(4-methylphenyl)sulfonylamino]methyl]cyclopentyl] 4-methylbenzenesulfonate

Systemtic Name: [1-[[(4-methylphenyl)sulfonylamino]methyl]cyclopentyl] 4-methylbenzenesulfonate Openeye Name: [1-[(p-tolylsulfonylamino)methyl]cyclopentyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [1-[[(4-methylphenyl)sulfonylamino]methyl]cyclopentyl] ester IUPAC Name: [1-[[(4-methylphenyl)sulfonylamino]methyl]cyclopentyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [1-[(tosylamino)methyl]cyclopentyl] ester Formula: C20H25NO5S2 MolecularWeight: 423.5462

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NCC2(CCCC2)OS(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NCC2(CCCC2)OS(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C20H25NO5S2/c1-16-5-9-18(10-6-16)27(22,23)21-15-20(13-3-4-14-20)26-28(24,25)19-11-7-17(2)8-12-19/h5-12,21H,3-4,13-15H2,1-2H3