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

Systemtic Name: ethyl 5-[2-(2-chloranyl-4-nitro-phenoxy)ethanoylamino]-3-methyl-thiophene-2-carboxylate Openeye Name: ethyl 5-[[2-(2-chloro-4-nitro-phenoxy)acetyl]amino]-3-methyl-thiophene-2-carboxylate CAS Name: 5-[[2-(2-chloro-4-nitrophenoxy)-1-oxoethyl]amino]-3-methyl-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[[2-(2-chloro-4-nitrophenoxy)acetyl]amino]-3-methylthiophene-2-carboxylate Traditional Name: 5-[[2-(2-chloro-4-nitro-phenoxy)acetyl]amino]-3-methyl-thiophene-2-carboxylic acid ethyl ester Formula: C16H15ClN2O6S MolecularWeight: 398.8181

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C(S1)NC(=O)COC2=C(C=C(C=C2)[N+](=O)[O-])Cl)C

Isomeric SMILES

CCOC(=O)C1=C(C=C(S1)NC(=O)COC2=C(C=C(C=C2)[N+](=O)[O-])Cl)C

InChI

InChI=1S/C16H15ClN2O6S/c1-3-24-16(21)15-9(2)6-14(26-15)18-13(20)8-25-12-5-4-10(19(22)23)7-11(12)17/h4-7H,3,8H2,1-2H3,(H,18,20)