2-methylpropyl 3-(4-nitrophenyl)carbonyl-2-[4-(trifluoromethyl)phenyl]-1,3-thiazolidine-4-carboxylate

Systemtic Name: 2-methylpropyl 3-(4-nitrophenyl)carbonyl-2-[4-(trifluoromethyl)phenyl]-1,3-thiazolidine-4-carboxylate Openeye Name: isobutyl 3-(4-nitrobenzoyl)-2-[4-(trifluoromethyl)phenyl]thiazolidine-4-carboxylate CAS Name: 3-[(4-nitrophenyl)-oxomethyl]-2-[4-(trifluoromethyl)phenyl]-4-thiazolidinecarboxylic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 3-(4-nitrobenzoyl)-2-[4-(trifluoromethyl)phenyl]-1,3-thiazolidine-4-carboxylate Traditional Name: 3-(4-nitrobenzoyl)-2-[4-(trifluoromethyl)phenyl]thiazolidine-4-carboxylic acid isobutyl ester Formula: C22H21F3N2O5S MolecularWeight: 482.47275

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC(=O)C1CSC(N1C(=O)C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

CC(C)COC(=O)C1CSC(N1C(=O)C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C22H21F3N2O5S/c1-13(2)11-32-21(29)18-12-33-20(15-3-7-16(8-4-15)22(23,24)25)26(18)19(28)14-5-9-17(10-6-14)27(30)31/h3-10,13,18,20H,11-12H2,1-2H3