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

Systemtic Name: ethyl 2-(4-chloranyl-3-nitro-phenyl)-4-methyl-1,3-thiazole-5-carboxylate Openeye Name: ethyl 2-(4-chloro-3-nitro-phenyl)-4-methyl-thiazole-5-carboxylate CAS Name: 2-(4-chloro-3-nitrophenyl)-4-methyl-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-(4-chloro-3-nitrophenyl)-4-methyl-1,3-thiazole-5-carboxylate Traditional Name: 2-(4-chloro-3-nitro-phenyl)-4-methyl-thiazole-5-carboxylic acid ethyl ester Formula: C13H11ClN2O4S MolecularWeight: 326.75544

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H11ClN2O4S/c1-3-20-13(17)11-7(2)15-12(21-11)8-4-5-9(14)10(6-8)16(18)19/h4-6H,3H2,1-2H3