N-[2-[(2S)-3-[[1-[(4-chlorophenyl)methyl]piperidin-4-yl]amino]-2-oxidanyl-propoxy]phenyl]ethanamide; 2,2,2-tris(fluoranyl)ethanoic acid

Systemtic Name: N-[2-[(2S)-3-[[1-[(4-chlorophenyl)methyl]piperidin-4-yl]amino]-2-oxidanyl-propoxy]phenyl]ethanamide; 2,2,2-tris(fluoranyl)ethanoic acid Openeye Name: N-[2-[(2S)-3-[[1-[(4-chlorophenyl)methyl]-4-piperidyl]amino]-2-hydroxy-propoxy]phenyl]acetamide; 2,2,2-trifluoroacetic acid CAS Name: N-[2-[(2S)-3-[[1-[(4-chlorophenyl)methyl]-4-piperidinyl]amino]-2-hydroxypropoxy]phenyl]acetamide; 2,2,2-trifluoroacetic acid IUPAC Name: N-[2-[(2S)-3-[[1-[(4-chlorophenyl)methyl]piperidin-4-yl]amino]-2-hydroxypropoxy]phenyl]acetamide; 2,2,2-trifluoroacetic acid Traditional Name: N-[2-[(2S)-3-[[1-(4-chlorobenzyl)-4-piperidyl]amino]-2-hydroxy-propoxy]phenyl]acetamide; 2,2,2-trifluoroacetic acid Formula: C25H31ClF3N3O5 MolecularWeight: 545.97895

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=CC=C1OCC(CNC2CCN(CC2)CC3=CC=C(C=C3)Cl)O.C(=O)(C(F)(F)F)O

Isomeric SMILES

CC(=O)NC1=CC=CC=C1OC[C@H](CNC2CCN(CC2)CC3=CC=C(C=C3)Cl)O.C(=O)(C(F)(F)F)O

InChI

InChI=1S/C23H30ClN3O3.C2HF3O2/c1-17(28)26-22-4-2-3-5-23(22)30-16-21(29)14-25-20-10-12-27(13-11-20)15-18-6-8-19(24)9-7-18;3-2(4,5)1(6)7/h2-9,20-21,25,29H,10-16H2,1H3,(H,26,28);(H,6,7)/t21-;/m0./s1