tert-butyl 4-[5-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]-2-(1,3-thiazolidin-3-ylcarbonyl)pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl 4-[5-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]-2-(1,3-thiazolidin-3-ylcarbonyl)pyrrolidine-1-carboxylate Openeye Name: tert-butyl 4-(5-nitro-1,3-dioxo-isoindolin-2-yl)-2-(thiazolidine-3-carbonyl)pyrrolidine-1-carboxylate CAS Name: 4-(5-nitro-1,3-dioxo-2-isoindolyl)-2-[oxo(3-thiazolidinyl)methyl]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(5-nitro-1,3-dioxoisoindol-2-yl)-2-(1,3-thiazolidine-3-carbonyl)pyrrolidine-1-carboxylate Traditional Name: 4-(1,3-diketo-5-nitro-isoindolin-2-yl)-2-(thiazolidine-3-carbonyl)pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C21H24N4O7S MolecularWeight: 476.50286

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CC(CC1C(=O)N2CCSC2)N3C(=O)C4=C(C3=O)C=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)N1CC(CC1C(=O)N2CCSC2)N3C(=O)C4=C(C3=O)C=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H24N4O7S/c1-21(2,3)32-20(29)23-10-13(9-16(23)19(28)22-6-7-33-11-22)24-17(26)14-5-4-12(25(30)31)8-15(14)18(24)27/h4-5,8,13,16H,6-7,9-11H2,1-3H3