2-azanyl-1-(4-methoxyphenyl)-4-methyl-pentan-1-one; 2,2,2-tris(fluoranyl)ethanoic acid

Systemtic Name: 2-azanyl-1-(4-methoxyphenyl)-4-methyl-pentan-1-one; 2,2,2-tris(fluoranyl)ethanoic acid Openeye Name: 2-amino-1-(4-methoxyphenyl)-4-methyl-pentan-1-one; 2,2,2-trifluoroacetic acid CAS Name: 2-amino-1-(4-methoxyphenyl)-4-methyl-1-pentanone; 2,2,2-trifluoroacetic acid IUPAC Name: 2-amino-1-(4-methoxyphenyl)-4-methylpentan-1-one; 2,2,2-trifluoroacetic acid Traditional Name: 2-amino-1-(4-methoxyphenyl)-4-methyl-pentan-1-one; 2,2,2-trifluoroacetic acid Formula: C15H20F3NO4 MolecularWeight: 335.31881

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)C1=CC=C(C=C1)OC)N.C(=O)(C(F)(F)F)O

Isomeric SMILES

CC(C)CC(C(=O)C1=CC=C(C=C1)OC)N.C(=O)(C(F)(F)F)O

InChI

InChI=1S/C13H19NO2.C2HF3O2/c1-9(2)8-12(14)13(15)10-4-6-11(16-3)7-5-10;3-2(4,5)1(6)7/h4-7,9,12H,8,14H2,1-3H3;(H,6,7)