ethyl 5-[2-(2-chloranyl-4-nitro-phenoxy)ethanoylamino]-3-methyl-1,2-thiazole-4-carboxylate

Systemtic Name: ethyl 5-[2-(2-chloranyl-4-nitro-phenoxy)ethanoylamino]-3-methyl-1,2-thiazole-4-carboxylate Openeye Name: ethyl 5-[[2-(2-chloro-4-nitro-phenoxy)acetyl]amino]-3-methyl-isothiazole-4-carboxylate CAS Name: 5-[[2-(2-chloro-4-nitrophenoxy)-1-oxoethyl]amino]-3-methyl-4-isothiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[[2-(2-chloro-4-nitrophenoxy)acetyl]amino]-3-methyl-1,2-thiazole-4-carboxylate Traditional Name: 5-[[2-(2-chloro-4-nitro-phenoxy)acetyl]amino]-3-methyl-isothiazole-4-carboxylic acid ethyl ester Formula: C15H14ClN3O6S MolecularWeight: 399.80616

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SN=C1C)NC(=O)COC2=C(C=C(C=C2)[N+](=O)[O-])Cl

Isomeric SMILES

CCOC(=O)C1=C(SN=C1C)NC(=O)COC2=C(C=C(C=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C15H14ClN3O6S/c1-3-24-15(21)13-8(2)18-26-14(13)17-12(20)7-25-11-5-4-9(19(22)23)6-10(11)16/h4-6H,3,7H2,1-2H3,(H,17,20)