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

Systemtic Name: 2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl 1-(4-chlorophenyl)sulfonylpyrrolidine-2-carboxylate Openeye Name: 2-(1,3-dioxoisoindolin-2-yl)ethyl 1-(4-chlorophenyl)sulfonylpyrrolidine-2-carboxylate CAS Name: 1-(4-chlorophenyl)sulfonyl-2-pyrrolidinecarboxylic acid 2-(1,3-dioxo-2-isoindolyl)ethyl ester IUPAC Name: 2-(1,3-dioxoisoindol-2-yl)ethyl 1-(4-chlorophenyl)sulfonylpyrrolidine-2-carboxylate Traditional Name: 1-(4-chlorophenyl)sulfonylpyrrolidine-2-carboxylic acid 2-phthalimidoethyl ester Formula: C21H19ClN2O6S MolecularWeight: 462.90336

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)S(=O)(=O)C2=CC=C(C=C2)Cl)C(=O)OCCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

C1CC(N(C1)S(=O)(=O)C2=CC=C(C=C2)Cl)C(=O)OCCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C21H19ClN2O6S/c22-14-7-9-15(10-8-14)31(28,29)24-11-3-6-18(24)21(27)30-13-12-23-19(25)16-4-1-2-5-17(16)20(23)26/h1-2,4-5,7-10,18H,3,6,11-13H2