ethyl 4-cyano-3-methyl-5-[2-(2-nitrophenoxy)ethanoylamino]thiophene-2-carboxylate

Systemtic Name: ethyl 4-cyano-3-methyl-5-[2-(2-nitrophenoxy)ethanoylamino]thiophene-2-carboxylate Openeye Name: ethyl 4-cyano-3-methyl-5-[[2-(2-nitrophenoxy)acetyl]amino]thiophene-2-carboxylate CAS Name: 4-cyano-3-methyl-5-[[2-(2-nitrophenoxy)-1-oxoethyl]amino]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-cyano-3-methyl-5-[[2-(2-nitrophenoxy)acetyl]amino]thiophene-2-carboxylate Traditional Name: 4-cyano-3-methyl-5-[[2-(2-nitrophenoxy)acetyl]amino]thiophene-2-carboxylic acid ethyl ester Formula: C17H15N3O6S MolecularWeight: 389.3825

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H15N3O6S/c1-3-25-17(22)15-10(2)11(8-18)16(27-15)19-14(21)9-26-13-7-5-4-6-12(13)20(23)24/h4-7H,3,9H2,1-2H3,(H,19,21)