3-(4-chloranyl-3-nitro-phenyl)carbonyl-2-(3,4-dichlorophenyl)-1,3-thiazolidine-4-carboxylic acid

Systemtic Name: 3-(4-chloranyl-3-nitro-phenyl)carbonyl-2-(3,4-dichlorophenyl)-1,3-thiazolidine-4-carboxylic acid Openeye Name: 3-(4-chloro-3-nitro-benzoyl)-2-(3,4-dichlorophenyl)thiazolidine-4-carboxylic acid CAS Name: 3-[(4-chloro-3-nitrophenyl)-oxomethyl]-2-(3,4-dichlorophenyl)-4-thiazolidinecarboxylic acid IUPAC Name: 3-(4-chloro-3-nitrobenzoyl)-2-(3,4-dichlorophenyl)-1,3-thiazolidine-4-carboxylic acid Traditional Name: 3-(4-chloro-3-nitro-benzoyl)-2-(3,4-dichlorophenyl)thiazolidine-4-carboxylic acid Formula: C17H11Cl3N2O5S MolecularWeight: 461.70364

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(C(S1)C2=CC(=C(C=C2)Cl)Cl)C(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-])C(=O)O

Isomeric SMILES

C1C(N(C(S1)C2=CC(=C(C=C2)Cl)Cl)C(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C17H11Cl3N2O5S/c18-10-3-2-9(5-12(10)20)16-21(14(7-28-16)17(24)25)15(23)8-1-4-11(19)13(6-8)22(26)27/h1-6,14,16H,7H2,(H,24,25)