2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl 1-(4-methylphenyl)sulfonylpyrrolidine-2-carboxylate

Systemtic Name: 2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl 1-(4-methylphenyl)sulfonylpyrrolidine-2-carboxylate Openeye Name: 2-(1,3-dioxoisoindolin-2-yl)ethyl 1-(p-tolylsulfonyl)pyrrolidine-2-carboxylate CAS Name: 1-(4-methylphenyl)sulfonyl-2-pyrrolidinecarboxylic acid 2-(1,3-dioxo-2-isoindolyl)ethyl ester IUPAC Name: 2-(1,3-dioxoisoindol-2-yl)ethyl 1-(4-methylphenyl)sulfonylpyrrolidine-2-carboxylate Traditional Name: 1-tosylpyrrolidine-2-carboxylic acid 2-phthalimidoethyl ester Formula: C22H22N2O6S MolecularWeight: 442.48488

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC2C(=O)OCCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC2C(=O)OCCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C22H22N2O6S/c1-15-8-10-16(11-9-15)31(28,29)24-12-4-7-19(24)22(27)30-14-13-23-20(25)17-5-2-3-6-18(17)21(23)26/h2-3,5-6,8-11,19H,4,7,12-14H2,1H3