(4-methoxycarbonylphenyl) (2S)-1-(4-methylphenyl)sulfonylpyrrolidine-2-carboxylate

Systemtic Name: (4-methoxycarbonylphenyl) (2S)-1-(4-methylphenyl)sulfonylpyrrolidine-2-carboxylate Openeye Name: (4-methoxycarbonylphenyl) (2S)-1-(p-tolylsulfonyl)pyrrolidine-2-carboxylate CAS Name: (2S)-1-(4-methylphenyl)sulfonyl-2-pyrrolidinecarboxylic acid (4-methoxycarbonylphenyl) ester IUPAC Name: (4-methoxycarbonylphenyl) (2S)-1-(4-methylphenyl)sulfonylpyrrolidine-2-carboxylate Traditional Name: (2S)-1-tosylpyrrolidine-2-carboxylic acid (4-carbomethoxyphenyl) ester Formula: C20H21NO6S MolecularWeight: 403.44884

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC2C(=O)OC3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC[C@H]2C(=O)OC3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C20H21NO6S/c1-14-5-11-17(12-6-14)28(24,25)21-13-3-4-18(21)20(23)27-16-9-7-15(8-10-16)19(22)26-2/h5-12,18H,3-4,13H2,1-2H3/t18-/m0/s1