ethanoyl fluoride; 1-[3-(phenylmethyl)imidazol-4-yl]ethanamine

Systemtic Name: ethanoyl fluoride; 1-[3-(phenylmethyl)imidazol-4-yl]ethanamine Openeye Name: acetyl fluoride; 1-(3-benzylimidazol-4-yl)ethanamine CAS Name: acetyl fluoride; 1-[3-(phenylmethyl)-4-imidazolyl]ethanamine IUPAC Name: acetyl fluoride; 1-(3-benzylimidazol-4-yl)ethanamine Traditional Name: acetyl fluoride; 1-(3-benzylimidazol-4-yl)ethylamine Formula: C18H24F3N3O3 MolecularWeight: 387.39667

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CN=CN1CC2=CC=CC=C2)N.CC(=O)F.CC(=O)F.CC(=O)F

Isomeric SMILES

CC(C1=CN=CN1CC2=CC=CC=C2)N.CC(=O)F.CC(=O)F.CC(=O)F

InChI

InChI=1S/C12H15N3.3C2H3FO/c1-10(13)12-7-14-9-15(12)8-11-5-3-2-4-6-11;3*1-2(3)4/h2-7,9-10H,8,13H2,1H3;3*1H3