N-[2-(4-ethoxyphenoxy)ethyl]-4-[5-(trifluoromethyl)pyridin-2-yl]piperazine-1-carboxamide

Systemtic Name: N-[2-(4-ethoxyphenoxy)ethyl]-4-[5-(trifluoromethyl)pyridin-2-yl]piperazine-1-carboxamide Openeye Name: N-[2-(4-ethoxyphenoxy)ethyl]-4-[5-(trifluoromethyl)-2-pyridyl]piperazine-1-carboxamide CAS Name: N-[2-(4-ethoxyphenoxy)ethyl]-4-[5-(trifluoromethyl)-2-pyridinyl]-1-piperazinecarboxamide IUPAC Name: N-[2-(4-ethoxyphenoxy)ethyl]-4-[5-(trifluoromethyl)pyridin-2-yl]piperazine-1-carboxamide Traditional Name: N-[2-(4-ethoxyphenoxy)ethyl]-4-[5-(trifluoromethyl)-2-pyridyl]piperazine-1-carboxamide Formula: C21H25F3N4O3 MolecularWeight: 438.44341

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)OCCNC(=O)N2CCN(CC2)C3=NC=C(C=C3)C(F)(F)F

Isomeric SMILES

CCOC1=CC=C(C=C1)OCCNC(=O)N2CCN(CC2)C3=NC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C21H25F3N4O3/c1-2-30-17-4-6-18(7-5-17)31-14-9-25-20(29)28-12-10-27(11-13-28)19-8-3-16(15-26-19)21(22,23)24/h3-8,15H,2,9-14H2,1H3,(H,25,29)