2-methyl-2-[3-[4-[4-(trifluoromethyl)phenyl]carbonylpiperazin-1-yl]phenoxy]propanoate

Systemtic Name: 2-methyl-2-[3-[4-[4-(trifluoromethyl)phenyl]carbonylpiperazin-1-yl]phenoxy]propanoate Openeye Name: 2-methyl-2-[3-[4-[4-(trifluoromethyl)benzoyl]piperazin-1-yl]phenoxy]propanoate CAS Name: 2-methyl-2-[3-[4-[oxo-[4-(trifluoromethyl)phenyl]methyl]-1-piperazinyl]phenoxy]propanoate IUPAC Name: 2-methyl-2-[3-[4-[4-(trifluoromethyl)benzoyl]piperazin-1-yl]phenoxy]propanoate Traditional Name: 2-methyl-2-[3-[4-[4-(trifluoromethyl)benzoyl]piperazino]phenoxy]propionate Formula: C22H22F3N2O4- MolecularWeight: 435.41629

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)[O-])OC1=CC=CC(=C1)N2CCN(CC2)C(=O)C3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

CC(C)(C(=O)[O-])OC1=CC=CC(=C1)N2CCN(CC2)C(=O)C3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C22H23F3N2O4/c1-21(2,20(29)30)31-18-5-3-4-17(14-18)26-10-12-27(13-11-26)19(28)15-6-8-16(9-7-15)22(23,24)25/h3-9,14H,10-13H2,1-2H3,(H,29,30)/p-1