(3-fluoranyl-4-methoxy-phenyl)methyl (2R)-4-methyl-2-[(4-methylphenyl)sulfonylamino]pentanoate

Systemtic Name: (3-fluoranyl-4-methoxy-phenyl)methyl (2R)-4-methyl-2-[(4-methylphenyl)sulfonylamino]pentanoate Openeye Name: (3-fluoro-4-methoxy-phenyl)methyl (2R)-4-methyl-2-(p-tolylsulfonylamino)pentanoate CAS Name: (2R)-4-methyl-2-[(4-methylphenyl)sulfonylamino]pentanoic acid (3-fluoro-4-methoxyphenyl)methyl ester IUPAC Name: (3-fluoro-4-methoxyphenyl)methyl (2R)-4-methyl-2-[(4-methylphenyl)sulfonylamino]pentanoate Traditional Name: (2R)-4-methyl-2-(tosylamino)valeric acid (3-fluoro-4-methoxy-benzyl) ester Formula: C21H26FNO5S MolecularWeight: 423.498243

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(CC(C)C)C(=O)OCC2=CC(=C(C=C2)OC)F

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N[C@H](CC(C)C)C(=O)OCC2=CC(=C(C=C2)OC)F

InChI

InChI=1S/C21H26FNO5S/c1-14(2)11-19(23-29(25,26)17-8-5-15(3)6-9-17)21(24)28-13-16-7-10-20(27-4)18(22)12-16/h5-10,12,14,19,23H,11,13H2,1-4H3/t19-/m1/s1