ethanoyl fluoride; (2-pyrazol-1-ylphenyl)methanamine

Systemtic Name: ethanoyl fluoride; (2-pyrazol-1-ylphenyl)methanamine Openeye Name: acetyl fluoride; (2-pyrazol-1-ylphenyl)methanamine CAS Name: acetyl fluoride; [2-(1-pyrazolyl)phenyl]methanamine IUPAC Name: acetyl fluoride; (2-pyrazol-1-ylphenyl)methanamine Traditional Name: acetyl fluoride; (2-pyrazol-1-ylbenzyl)amine Formula: C16H20F3N3O3 MolecularWeight: 359.34351

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)F.CC(=O)F.CC(=O)F.C1=CC=C(C(=C1)CN)N2C=CC=N2

Isomeric SMILES

CC(=O)F.CC(=O)F.CC(=O)F.C1=CC=C(C(=C1)CN)N2C=CC=N2

InChI

InChI=1S/C10H11N3.3C2H3FO/c11-8-9-4-1-2-5-10(9)13-7-3-6-12-13;3*1-2(3)4/h1-7H,8,11H2;3*1H3