[1-(4-methylphenyl)sulfonylpyrrolidin-2-yl]methyl 4-methylbenzenesulfonate

Systemtic Name: [1-(4-methylphenyl)sulfonylpyrrolidin-2-yl]methyl 4-methylbenzenesulfonate Openeye Name: [1-(p-tolylsulfonyl)pyrrolidin-2-yl]methyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [1-(4-methylphenyl)sulfonyl-2-pyrrolidinyl]methyl ester IUPAC Name: [1-(4-methylphenyl)sulfonylpyrrolidin-2-yl]methyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (1-tosylpyrrolidin-2-yl)methyl ester Formula: C19H23NO5S2 MolecularWeight: 409.51962

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC2COS(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC2COS(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C19H23NO5S2/c1-15-5-9-18(10-6-15)26(21,22)20-13-3-4-17(20)14-25-27(23,24)19-11-7-16(2)8-12-19/h5-12,17H,3-4,13-14H2,1-2H3