ethyl (E)-2-fluoranyl-3-[4-(imidazol-1-ylmethyl)phenyl]but-2-enoate

Systemtic Name: ethyl (E)-2-fluoranyl-3-[4-(imidazol-1-ylmethyl)phenyl]but-2-enoate Openeye Name: ethyl (E)-2-fluoro-3-[4-(imidazol-1-ylmethyl)phenyl]but-2-enoate CAS Name: (E)-2-fluoro-3-[4-(1-imidazolylmethyl)phenyl]-2-butenoic acid ethyl ester IUPAC Name: ethyl (E)-2-fluoro-3-[4-(imidazol-1-ylmethyl)phenyl]but-2-enoate Traditional Name: (E)-2-fluoro-3-[4-(imidazol-1-ylmethyl)phenyl]but-2-enoic acid ethyl ester Formula: C16H17FN2O2 MolecularWeight: 288.316783

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=C(C)C1=CC=C(C=C1)CN2C=CN=C2)F

Isomeric SMILES

CCOC(=O)/C(=C(/C)\C1=CC=C(C=C1)CN2C=CN=C2)/F

InChI

InChI=1S/C16H17FN2O2/c1-3-21-16(20)15(17)12(2)14-6-4-13(5-7-14)10-19-9-8-18-11-19/h4-9,11H,3,10H2,1-2H3/b15-12+