2-[[2,5-bis(chloranyl)phenyl]-(4-chlorophenyl)sulfonyl-amino]propyl 2-(hydroxymethyl)pyrrolidine-1-carboxylate

Systemtic Name: 2-[[2,5-bis(chloranyl)phenyl]-(4-chlorophenyl)sulfonyl-amino]propyl 2-(hydroxymethyl)pyrrolidine-1-carboxylate Openeye Name: 2-(2,5-dichloro-N-(4-chlorophenyl)sulfonyl-anilino)propyl 2-(hydroxymethyl)pyrrolidine-1-carboxylate CAS Name: 2-(hydroxymethyl)-1-pyrrolidinecarboxylic acid 2-(2,5-dichloro-N-(4-chlorophenyl)sulfonylanilino)propyl ester IUPAC Name: 2-(2,5-dichloro-N-(4-chlorophenyl)sulfonylanilino)propyl 2-(hydroxymethyl)pyrrolidine-1-carboxylate Traditional Name: 2-methylolpyrrolidine-1-carboxylic acid 2-(2,5-dichloro-N-(4-chlorophenyl)sulfonyl-anilino)propyl ester Formula: C21H23Cl3N2O5S MolecularWeight: 521.84172

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC(=O)N1CCCC1CO)N(C2=C(C=CC(=C2)Cl)Cl)S(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC(COC(=O)N1CCCC1CO)N(C2=C(C=CC(=C2)Cl)Cl)S(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H23Cl3N2O5S/c1-14(13-31-21(28)25-10-2-3-17(25)12-27)26(20-11-16(23)6-9-19(20)24)32(29,30)18-7-4-15(22)5-8-18/h4-9,11,14,17,27H,2-3,10,12-13H2,1H3