ethyl 5-azanyl-4-cyano-3-[(5-fluoranyl-2-nitro-phenoxy)methyl]thiophene-2-carboxylate

Systemtic Name: ethyl 5-azanyl-4-cyano-3-[(5-fluoranyl-2-nitro-phenoxy)methyl]thiophene-2-carboxylate Openeye Name: ethyl 5-amino-4-cyano-3-[(5-fluoro-2-nitro-phenoxy)methyl]thiophene-2-carboxylate CAS Name: 5-amino-4-cyano-3-[(5-fluoro-2-nitrophenoxy)methyl]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-4-cyano-3-[(5-fluoro-2-nitrophenoxy)methyl]thiophene-2-carboxylate Traditional Name: 5-amino-4-cyano-3-[(5-fluoro-2-nitro-phenoxy)methyl]thiophene-2-carboxylic acid ethyl ester Formula: C15H12FN3O5S MolecularWeight: 365.336283

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H12FN3O5S/c1-2-23-15(20)13-10(9(6-17)14(18)25-13)7-24-12-5-8(16)3-4-11(12)19(21)22/h3-5H,2,7,18H2,1H3