(3-fluoranyl-4-methoxy-phenyl)methyl (2S)-2-[(4-tert-butylphenyl)carbonylamino]propanoate

Systemtic Name: (3-fluoranyl-4-methoxy-phenyl)methyl (2S)-2-[(4-tert-butylphenyl)carbonylamino]propanoate Openeye Name: (3-fluoro-4-methoxy-phenyl)methyl (2S)-2-[(4-tert-butylbenzoyl)amino]propanoate CAS Name: (2S)-2-[[(4-tert-butylphenyl)-oxomethyl]amino]propanoic acid (3-fluoro-4-methoxyphenyl)methyl ester IUPAC Name: (3-fluoro-4-methoxyphenyl)methyl (2S)-2-[(4-tert-butylbenzoyl)amino]propanoate Traditional Name: (2S)-2-[(4-tert-butylbenzoyl)amino]propionic acid (3-fluoro-4-methoxy-benzyl) ester Formula: C22H26FNO4 MolecularWeight: 387.444543

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[C@@H](C(=O)OCC1=CC(=C(C=C1)OC)F)NC(=O)C2=CC=C(C=C2)C(C)(C)C

InChI

InChI=1S/C22H26FNO4/c1-14(21(26)28-13-15-6-11-19(27-5)18(23)12-15)24-20(25)16-7-9-17(10-8-16)22(2,3)4/h6-12,14H,13H2,1-5H3,(H,24,25)/t14-/m0/s1