2-methylbenzamide; 2,2,2-tris(fluoranyl)ethanoic acid

Systemtic Name: 2-methylbenzamide; 2,2,2-tris(fluoranyl)ethanoic acid Openeye Name: 2-methylbenzamide; 2,2,2-trifluoroacetic acid CAS Name: 2-methylbenzamide; 2,2,2-trifluoroacetic acid IUPAC Name: 2-methylbenzamide; 2,2,2-trifluoroacetic acid Traditional Name: 2-methylbenzamide; 2,2,2-trifluoroacetic acid Formula: C12H11F6NO5 MolecularWeight: 363.209859

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)N.C(=O)(C(F)(F)F)O.C(=O)(C(F)(F)F)O

Isomeric SMILES

CC1=CC=CC=C1C(=O)N.C(=O)(C(F)(F)F)O.C(=O)(C(F)(F)F)O

InChI

InChI=1S/C8H9NO.2C2HF3O2/c1-6-4-2-3-5-7(6)8(9)10;2*3-2(4,5)1(6)7/h2-5H,1H3,(H2,9,10);2*(H,6,7)