ethyl 3-[2-fluoranyl-1-(triphenylmethyl)imidazol-4-yl]-2-isocyano-propanoate

Systemtic Name: ethyl 3-[2-fluoranyl-1-(triphenylmethyl)imidazol-4-yl]-2-isocyano-propanoate Openeye Name: ethyl 3-(2-fluoro-1-trityl-imidazol-4-yl)-2-isocyano-propanoate CAS Name: 3-[2-fluoro-1-(triphenylmethyl)-4-imidazolyl]-2-isocyanopropanoic acid ethyl ester IUPAC Name: ethyl 3-(2-fluoro-1-tritylimidazol-4-yl)-2-isocyanopropanoate Traditional Name: 3-(2-fluoro-1-trityl-imidazol-4-yl)-2-isocyano-propionic acid ethyl ester Formula: C28H24FN3O2 MolecularWeight: 453.507463

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CN(C(=N1)F)C(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)[N+]#[C-]

Isomeric SMILES

CCOC(=O)C(CC1=CN(C(=N1)F)C(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)[N+]#[C-]

InChI

InChI=1S/C28H24FN3O2/c1-3-34-26(33)25(30-2)19-24-20-32(27(29)31-24)28(21-13-7-4-8-14-21,22-15-9-5-10-16-22)23-17-11-6-12-18-23/h4-18,20,25H,3,19H2,1H3