ethyl 3-(2-chloranyl-4-nitro-phenyl)carbonyl-2-(3-phenoxyphenyl)-1,3-thiazolidine-4-carboxylate

Systemtic Name: ethyl 3-(2-chloranyl-4-nitro-phenyl)carbonyl-2-(3-phenoxyphenyl)-1,3-thiazolidine-4-carboxylate Openeye Name: ethyl 3-(2-chloro-4-nitro-benzoyl)-2-(3-phenoxyphenyl)thiazolidine-4-carboxylate CAS Name: 3-[(2-chloro-4-nitrophenyl)-oxomethyl]-2-(3-phenoxyphenyl)-4-thiazolidinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-(2-chloro-4-nitrobenzoyl)-2-(3-phenoxyphenyl)-1,3-thiazolidine-4-carboxylate Traditional Name: 3-(2-chloro-4-nitro-benzoyl)-2-(3-phenoxyphenyl)thiazolidine-4-carboxylic acid ethyl ester Formula: C25H21ClN2O6S MolecularWeight: 512.96204

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CSC(N1C(=O)C2=C(C=C(C=C2)[N+](=O)[O-])Cl)C3=CC(=CC=C3)OC4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1CSC(N1C(=O)C2=C(C=C(C=C2)[N+](=O)[O-])Cl)C3=CC(=CC=C3)OC4=CC=CC=C4

InChI

InChI=1S/C25H21ClN2O6S/c1-2-33-25(30)22-15-35-24(16-7-6-10-19(13-16)34-18-8-4-3-5-9-18)27(22)23(29)20-12-11-17(28(31)32)14-21(20)26/h3-14,22,24H,2,15H2,1H3