azane; [3-fluoranyl-5-(trifluoromethyl)phenyl]methanamine

Systemtic Name: azane; [3-fluoranyl-5-(trifluoromethyl)phenyl]methanamine Openeye Name: ammonia; [3-fluoro-5-(trifluoromethyl)phenyl]methanamine CAS Name: ammonia; [3-fluoro-5-(trifluoromethyl)phenyl]methanamine IUPAC Name: azane; [3-fluoro-5-(trifluoromethyl)phenyl]methanamine Traditional Name: ammonia; [3-fluoro-5-(trifluoromethyl)benzyl]amine Formula: C8H10F4N2 MolecularWeight: 210.172013

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C=C1C(F)(F)F)F)CN.N

Isomeric SMILES

C1=C(C=C(C=C1C(F)(F)F)F)CN.N

InChI

InChI=1S/C8H7F4N.H3N/c9-7-2-5(4-13)1-6(3-7)8(10,11)12;/h1-3H,4,13H2;1H3