methyl 2-[5-[1-(3-fluoranyl-4-isocyano-phenyl)-1-oxidanyl-ethyl]imidazol-1-yl]ethanoate

Systemtic Name: methyl 2-[5-[1-(3-fluoranyl-4-isocyano-phenyl)-1-oxidanyl-ethyl]imidazol-1-yl]ethanoate Openeye Name: methyl 2-[5-[1-(3-fluoro-4-isocyano-phenyl)-1-hydroxy-ethyl]imidazol-1-yl]acetate CAS Name: 2-[5-[1-(3-fluoro-4-isocyanophenyl)-1-hydroxyethyl]-1-imidazolyl]acetic acid methyl ester IUPAC Name: methyl 2-[5-[1-(3-fluoro-4-isocyanophenyl)-1-hydroxyethyl]imidazol-1-yl]acetate Traditional Name: 2-[5-[1-(3-fluoro-4-isocyano-phenyl)-1-hydroxy-ethyl]imidazol-1-yl]acetic acid methyl ester Formula: C15H14FN3O3 MolecularWeight: 303.288363

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=C(C=C1)[N+]#[C-])F)(C2=CN=CN2CC(=O)OC)O

Isomeric SMILES

CC(C1=CC(=C(C=C1)[N+]#[C-])F)(C2=CN=CN2CC(=O)OC)O

InChI

InChI=1S/C15H14FN3O3/c1-15(21,10-4-5-12(17-2)11(16)6-10)13-7-18-9-19(13)8-14(20)22-3/h4-7,9,21H,8H2,1,3H3