ethyl 2-(4-chloranyl-3-nitro-phenyl)-1,3-thiazole-5-carboxylate

Systemtic Name: ethyl 2-(4-chloranyl-3-nitro-phenyl)-1,3-thiazole-5-carboxylate Openeye Name: ethyl 2-(4-chloro-3-nitro-phenyl)thiazole-5-carboxylate CAS Name: 2-(4-chloro-3-nitrophenyl)-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-(4-chloro-3-nitrophenyl)-1,3-thiazole-5-carboxylate Traditional Name: 2-(4-chloro-3-nitro-phenyl)thiazole-5-carboxylic acid ethyl ester Formula: C12H9ClN2O4S MolecularWeight: 312.72886

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(S1)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CN=C(S1)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C12H9ClN2O4S/c1-2-19-12(16)10-6-14-11(20-10)7-3-4-8(13)9(5-7)15(17)18/h3-6H,2H2,1H3