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

Systemtic Name: (5-fluoranyl-2-methoxy-phenyl)methyl (2S)-2-[(4-tert-butylphenyl)carbonylamino]-3-methyl-butanoate Openeye Name: (5-fluoro-2-methoxy-phenyl)methyl (2S)-2-[(4-tert-butylbenzoyl)amino]-3-methyl-butanoate CAS Name: (2S)-2-[[(4-tert-butylphenyl)-oxomethyl]amino]-3-methylbutanoic acid (5-fluoro-2-methoxyphenyl)methyl ester IUPAC Name: (5-fluoro-2-methoxyphenyl)methyl (2S)-2-[(4-tert-butylbenzoyl)amino]-3-methylbutanoate Traditional Name: (2S)-2-[(4-tert-butylbenzoyl)amino]-3-methyl-butyric acid (5-fluoro-2-methoxy-benzyl) ester Formula: C24H30FNO4 MolecularWeight: 415.497703

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H30FNO4/c1-15(2)21(23(28)30-14-17-13-19(25)11-12-20(17)29-6)26-22(27)16-7-9-18(10-8-16)24(3,4)5/h7-13,15,21H,14H2,1-6H3,(H,26,27)/t21-/m0/s1