methyl (2R,3S)-2-[(4-methoxyphenyl)amino]-3-[[(2R)-3,3,3-tris(fluoranyl)-2-methoxy-2-phenyl-propanoyl]amino]butanoate

Systemtic Name: methyl (2R,3S)-2-[(4-methoxyphenyl)amino]-3-[[(2R)-3,3,3-tris(fluoranyl)-2-methoxy-2-phenyl-propanoyl]amino]butanoate Openeye Name: methyl (2R,3S)-2-(4-methoxyanilino)-3-[[(2R)-3,3,3-trifluoro-2-methoxy-2-phenyl-propanoyl]amino]butanoate CAS Name: (2R,3S)-2-(4-methoxyanilino)-3-[[(2R)-3,3,3-trifluoro-2-methoxy-1-oxo-2-phenylpropyl]amino]butanoic acid methyl ester IUPAC Name: methyl (2R,3S)-2-(4-methoxyanilino)-3-[[(2R)-3,3,3-trifluoro-2-methoxy-2-phenylpropanoyl]amino]butanoate Traditional Name: (2R,3S)-2-(p-anisidino)-3-[[(2R)-3,3,3-trifluoro-2-methoxy-2-phenyl-propanoyl]amino]butyric acid methyl ester Formula: C22H25F3N2O5 MolecularWeight: 454.43951

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(=O)OC)NC1=CC=C(C=C1)OC)NC(=O)C(C2=CC=CC=C2)(C(F)(F)F)OC

Isomeric SMILES

C[C@@H]([C@H](C(=O)OC)NC1=CC=C(C=C1)OC)NC(=O)[C@](C2=CC=CC=C2)(C(F)(F)F)OC

InChI

InChI=1S/C22H25F3N2O5/c1-14(18(19(28)31-3)27-16-10-12-17(30-2)13-11-16)26-20(29)21(32-4,22(23,24)25)15-8-6-5-7-9-15/h5-14,18,27H,1-4H3,(H,26,29)/t14-,18+,21+/m0/s1