(1-methylpiperidin-4-yl) 2-oxidanyl-2,2-bis[4-(trifluoromethyl)phenyl]ethanoate

Systemtic Name: (1-methylpiperidin-4-yl) 2-oxidanyl-2,2-bis[4-(trifluoromethyl)phenyl]ethanoate Openeye Name: (1-methyl-4-piperidyl) 2-hydroxy-2,2-bis[4-(trifluoromethyl)phenyl]acetate CAS Name: 2-hydroxy-2,2-bis[4-(trifluoromethyl)phenyl]acetic acid (1-methyl-4-piperidinyl) ester IUPAC Name: (1-methylpiperidin-4-yl) 2-hydroxy-2,2-bis[4-(trifluoromethyl)phenyl]acetate Traditional Name: 2-hydroxy-2,2-bis[4-(trifluoromethyl)phenyl]acetic acid (1-methyl-4-piperidyl) ester Formula: C22H21F6NO3 MolecularWeight: 461.397459

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(CC1)OC(=O)C(C2=CC=C(C=C2)C(F)(F)F)(C3=CC=C(C=C3)C(F)(F)F)O

Isomeric SMILES

CN1CCC(CC1)OC(=O)C(C2=CC=C(C=C2)C(F)(F)F)(C3=CC=C(C=C3)C(F)(F)F)O

InChI

InChI=1S/C22H21F6NO3/c1-29-12-10-18(11-13-29)32-19(30)20(31,14-2-6-16(7-3-14)21(23,24)25)15-4-8-17(9-5-15)22(26,27)28/h2-9,18,31H,10-13H2,1H3