ethyl 2-[2-(2-ethoxy-4-methanoyl-phenoxy)ethanoylamino]-5-ethyl-4-methyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-(2-ethoxy-4-methanoyl-phenoxy)ethanoylamino]-5-ethyl-4-methyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-(2-ethoxy-4-formyl-phenoxy)acetyl]amino]-5-ethyl-4-methyl-thiophene-3-carboxylate CAS Name: 2-[[2-(2-ethoxy-4-formylphenoxy)-1-oxoethyl]amino]-5-ethyl-4-methyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-(2-ethoxy-4-formylphenoxy)acetyl]amino]-5-ethyl-4-methylthiophene-3-carboxylate Traditional Name: 2-[[2-(2-ethoxy-4-formyl-phenoxy)acetyl]amino]-5-ethyl-4-methyl-thiophene-3-carboxylic acid ethyl ester Formula: C21H25NO6S MolecularWeight: 419.4913

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(S1)NC(=O)COC2=C(C=C(C=C2)C=O)OCC)C(=O)OCC)C

Isomeric SMILES

CCC1=C(C(=C(S1)NC(=O)COC2=C(C=C(C=C2)C=O)OCC)C(=O)OCC)C

InChI

InChI=1S/C21H25NO6S/c1-5-17-13(4)19(21(25)27-7-3)20(29-17)22-18(24)12-28-15-9-8-14(11-23)10-16(15)26-6-2/h8-11H,5-7,12H2,1-4H3,(H,22,24)