ethyl 6-azanyl-4-(3-bromanyl-4-fluoranyl-phenyl)-2-(chloromethyl)-5-cyano-4H-pyran-3-carboxylate

Systemtic Name: ethyl 6-azanyl-4-(3-bromanyl-4-fluoranyl-phenyl)-2-(chloromethyl)-5-cyano-4H-pyran-3-carboxylate Openeye Name: ethyl 6-amino-4-(3-bromo-4-fluoro-phenyl)-2-(chloromethyl)-5-cyano-4H-pyran-3-carboxylate CAS Name: 6-amino-4-(3-bromo-4-fluorophenyl)-2-(chloromethyl)-5-cyano-4H-pyran-3-carboxylic acid ethyl ester IUPAC Name: ethyl 6-amino-4-(3-bromo-4-fluorophenyl)-2-(chloromethyl)-5-cyano-4H-pyran-3-carboxylate Traditional Name: 6-amino-4-(3-bromo-4-fluoro-phenyl)-2-(chloromethyl)-5-cyano-4H-pyran-3-carboxylic acid ethyl ester Formula: C16H13BrClFN2O3 MolecularWeight: 415.641423

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC(=C(C1C2=CC(=C(C=C2)F)Br)C#N)N)CCl

Isomeric SMILES

CCOC(=O)C1=C(OC(=C(C1C2=CC(=C(C=C2)F)Br)C#N)N)CCl

InChI

InChI=1S/C16H13BrClFN2O3/c1-2-23-16(22)14-12(6-18)24-15(21)9(7-20)13(14)8-3-4-11(19)10(17)5-8/h3-5,13H,2,6,21H2,1H3