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(4-tert-butylphenyl)methyl 2-[[2-methylsulfonyl-3-(trifluoromethyl)phenyl]amino]ethanoate

(4-tert-butylphenyl)methyl 2-[[2-methylsulfonyl-3-(trifluoromethyl)phenyl]amino]ethanoate

Systemtic Name:(4-tert-butylphenyl)methyl 2-[[2-methylsulfonyl-3-(trifluoromethyl)phenyl]amino]ethanoate
Openeye Name:(4-tert-butylphenyl)methyl 2-[2-methylsulfonyl-3-(trifluoromethyl)anilino]acetate
CAS Name:2-[2-methylsulfonyl-3-(trifluoromethyl)anilino]acetic acid (4-tert-butylphenyl)methyl ester
IUPAC Name:(4-tert-butylphenyl)methyl 2-[2-methylsulfonyl-3-(trifluoromethyl)anilino]acetate
Traditional Name:2-[2-mesyl-3-(trifluoromethyl)anilino]acetic acid (4-tert-butylbenzyl) ester
Formula: C21H24F3NO4S
MolecularWeight: 443.47977
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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)COC(=O)CNC2=CC=CC(=C2S(=O)(=O)C)C(F)(F)F


Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)COC(=O)CNC2=CC=CC(=C2S(=O)(=O)C)C(F)(F)F


InChI

InChI=1S/C21H24F3NO4S/c1-20(2,3)15-10-8-14(9-11-15)13-29-18(26)12-25-17-7-5-6-16(21(22,23)24)19(17)30(4,27)28/h5-11,25H,12-13H2,1-4H3


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