[2-[4-[bis(fluoranyl)methoxy]phenyl]-2-oxidanylidene-ethyl] (2S)-3-methyl-2-(phenylmethoxycarbonylamino)butanoate

Systemtic Name: [2-[4-[bis(fluoranyl)methoxy]phenyl]-2-oxidanylidene-ethyl] (2S)-3-methyl-2-(phenylmethoxycarbonylamino)butanoate Openeye Name: [2-[4-(difluoromethoxy)phenyl]-2-oxo-ethyl] (2S)-2-(benzyloxycarbonylamino)-3-methyl-butanoate CAS Name: (2S)-3-methyl-2-(phenylmethoxycarbonylamino)butanoic acid [2-[4-(difluoromethoxy)phenyl]-2-oxoethyl] ester IUPAC Name: [2-[4-(difluoromethoxy)phenyl]-2-oxoethyl] (2S)-3-methyl-2-(phenylmethoxycarbonylamino)butanoate Traditional Name: (2S)-2-(benzyloxycarbonylamino)-3-methyl-butyric acid [2-[4-(difluoromethoxy)phenyl]-2-keto-ethyl] ester Formula: C22H23F2NO6 MolecularWeight: 435.417926

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(C)[C@@H](C(=O)OCC(=O)C1=CC=C(C=C1)OC(F)F)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C22H23F2NO6/c1-14(2)19(25-22(28)30-12-15-6-4-3-5-7-15)20(27)29-13-18(26)16-8-10-17(11-9-16)31-21(23)24/h3-11,14,19,21H,12-13H2,1-2H3,(H,25,28)/t19-/m0/s1