(5-ethanoyl-2-methoxy-phenyl)methyl 4-methyl-2-[[3-(trifluoromethyl)phenyl]sulfonylamino]pentanoate

Systemtic Name: (5-ethanoyl-2-methoxy-phenyl)methyl 4-methyl-2-[[3-(trifluoromethyl)phenyl]sulfonylamino]pentanoate Openeye Name: (5-acetyl-2-methoxy-phenyl)methyl 4-methyl-2-[[3-(trifluoromethyl)phenyl]sulfonylamino]pentanoate CAS Name: 4-methyl-2-[[3-(trifluoromethyl)phenyl]sulfonylamino]pentanoic acid (5-acetyl-2-methoxyphenyl)methyl ester IUPAC Name: (5-acetyl-2-methoxyphenyl)methyl 4-methyl-2-[[3-(trifluoromethyl)phenyl]sulfonylamino]pentanoate Traditional Name: 4-methyl-2-[[3-(trifluoromethyl)phenyl]sulfonylamino]valeric acid (5-acetyl-2-methoxy-benzyl) ester Formula: C23H26F3NO6S MolecularWeight: 501.51585

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OCC1=C(C=CC(=C1)C(=O)C)OC)NS(=O)(=O)C2=CC=CC(=C2)C(F)(F)F

Isomeric SMILES

CC(C)CC(C(=O)OCC1=C(C=CC(=C1)C(=O)C)OC)NS(=O)(=O)C2=CC=CC(=C2)C(F)(F)F

InChI

InChI=1S/C23H26F3NO6S/c1-14(2)10-20(27-34(30,31)19-7-5-6-18(12-19)23(24,25)26)22(29)33-13-17-11-16(15(3)28)8-9-21(17)32-4/h5-9,11-12,14,20,27H,10,13H2,1-4H3