N-(pyridin-4-ylmethyl)benzamide; 2,2,2-tris(fluoranyl)ethanoic acid

Systemtic Name: N-(pyridin-4-ylmethyl)benzamide; 2,2,2-tris(fluoranyl)ethanoic acid Openeye Name: N-(4-pyridylmethyl)benzamide; 2,2,2-trifluoroacetic acid CAS Name: N-(pyridin-4-ylmethyl)benzamide; 2,2,2-trifluoroacetic acid IUPAC Name: N-(pyridin-4-ylmethyl)benzamide; 2,2,2-trifluoroacetic acid Traditional Name: N-(4-pyridylmethyl)benzamide; 2,2,2-trifluoroacetic acid Formula: C17H14F6N2O5 MolecularWeight: 440.293879

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NCC2=CC=NC=C2.C(=O)(C(F)(F)F)O.C(=O)(C(F)(F)F)O

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NCC2=CC=NC=C2.C(=O)(C(F)(F)F)O.C(=O)(C(F)(F)F)O

InChI

InChI=1S/C13H12N2O.2C2HF3O2/c16-13(12-4-2-1-3-5-12)15-10-11-6-8-14-9-7-11;2*3-2(4,5)1(6)7/h1-9H,10H2,(H,15,16);2*(H,6,7)