ethyl 5-azanyl-4-cyano-3-(2-phenoxyethanoyloxymethyl)thiophene-2-carboxylate

Systemtic Name: ethyl 5-azanyl-4-cyano-3-(2-phenoxyethanoyloxymethyl)thiophene-2-carboxylate Openeye Name: ethyl 5-amino-4-cyano-3-[(2-phenoxyacetyl)oxymethyl]thiophene-2-carboxylate CAS Name: 5-amino-4-cyano-3-[(1-oxo-2-phenoxyethoxy)methyl]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-4-cyano-3-[(2-phenoxyacetyl)oxymethyl]thiophene-2-carboxylate Traditional Name: 5-amino-4-cyano-3-[(2-phenoxyacetyl)oxymethyl]thiophene-2-carboxylic acid ethyl ester Formula: C17H16N2O5S MolecularWeight: 360.38434

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16N2O5S/c1-2-22-17(21)15-13(12(8-18)16(19)25-15)9-24-14(20)10-23-11-6-4-3-5-7-11/h3-7H,2,9-10,19H2,1H3