ethyl 5-azanyl-4-cyano-3-[2-(4-methoxyphenoxy)ethanoyloxymethyl]thiophene-2-carboxylate

Systemtic Name: ethyl 5-azanyl-4-cyano-3-[2-(4-methoxyphenoxy)ethanoyloxymethyl]thiophene-2-carboxylate Openeye Name: ethyl 5-amino-4-cyano-3-[[2-(4-methoxyphenoxy)acetyl]oxymethyl]thiophene-2-carboxylate CAS Name: 5-amino-4-cyano-3-[[2-(4-methoxyphenoxy)-1-oxoethoxy]methyl]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-4-cyano-3-[[2-(4-methoxyphenoxy)acetyl]oxymethyl]thiophene-2-carboxylate Traditional Name: 5-amino-4-cyano-3-[[2-(4-methoxyphenoxy)acetyl]oxymethyl]thiophene-2-carboxylic acid ethyl ester Formula: C18H18N2O6S MolecularWeight: 390.41032

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)N)C#N)COC(=O)COC2=CC=C(C=C2)OC

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)N)C#N)COC(=O)COC2=CC=C(C=C2)OC

InChI

InChI=1S/C18H18N2O6S/c1-3-24-18(22)16-14(13(8-19)17(20)27-16)9-26-15(21)10-25-12-6-4-11(23-2)5-7-12/h4-7H,3,9-10,20H2,1-2H3