ethoxycarbonyl 3-[3-cyano-4-(dimethylamino)-2-fluoranyl-phenyl]propanoate

Systemtic Name: ethoxycarbonyl 3-[3-cyano-4-(dimethylamino)-2-fluoranyl-phenyl]propanoate Openeye Name: ethoxycarbonyl 3-[3-cyano-4-(dimethylamino)-2-fluoro-phenyl]propanoate CAS Name: 3-[3-cyano-4-(dimethylamino)-2-fluorophenyl]propanoic acid ethoxycarbonyl ester IUPAC Name: ethoxycarbonyl 3-[3-cyano-4-(dimethylamino)-2-fluorophenyl]propanoate Traditional Name: 3-[3-cyano-4-(dimethylamino)-2-fluoro-phenyl]propionic acid carbethoxy ester Formula: C15H17FN2O4 MolecularWeight: 308.304883

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)OC(=O)CCC1=C(C(=C(C=C1)N(C)C)C#N)F

Isomeric SMILES

CCOC(=O)OC(=O)CCC1=C(C(=C(C=C1)N(C)C)C#N)F

InChI

InChI=1S/C15H17FN2O4/c1-4-21-15(20)22-13(19)8-6-10-5-7-12(18(2)3)11(9-17)14(10)16/h5,7H,4,6,8H2,1-3H3