(1-pyridin-4-ylpiperidin-4-yl)methanamine; 2,2,2-tris(fluoranyl)ethanoic acid

Systemtic Name: (1-pyridin-4-ylpiperidin-4-yl)methanamine; 2,2,2-tris(fluoranyl)ethanoic acid Openeye Name: [1-(4-pyridyl)-4-piperidyl]methanamine; 2,2,2-trifluoroacetic acid CAS Name: (1-pyridin-4-yl-4-piperidinyl)methanamine; 2,2,2-trifluoroacetic acid IUPAC Name: (1-pyridin-4-ylpiperidin-4-yl)methanamine; 2,2,2-trifluoroacetic acid Traditional Name: [1-(4-pyridyl)-4-piperidyl]methylamine; 2,2,2-trifluoroacetic acid Formula: C17H20F9N3O6 MolecularWeight: 533.342829

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CN)C2=CC=NC=C2.C(=O)(C(F)(F)F)O.C(=O)(C(F)(F)F)O.C(=O)(C(F)(F)F)O

Isomeric SMILES

C1CN(CCC1CN)C2=CC=NC=C2.C(=O)(C(F)(F)F)O.C(=O)(C(F)(F)F)O.C(=O)(C(F)(F)F)O

InChI

InChI=1S/C11H17N3.3C2HF3O2/c12-9-10-3-7-14(8-4-10)11-1-5-13-6-2-11;3*3-2(4,5)1(6)7/h1-2,5-6,10H,3-4,7-9,12H2;3*(H,6,7)