methyl 3-bromanyl-3,3-bis(fluoranyl)-2-methyl-2-(phenylmethoxycarbonylamino)propanoate

Systemtic Name: methyl 3-bromanyl-3,3-bis(fluoranyl)-2-methyl-2-(phenylmethoxycarbonylamino)propanoate Openeye Name: methyl 2-(benzyloxycarbonylamino)-3-bromo-3,3-difluoro-2-methyl-propanoate CAS Name: 3-bromo-3,3-difluoro-2-methyl-2-(phenylmethoxycarbonylamino)propanoic acid methyl ester IUPAC Name: methyl 3-bromo-3,3-difluoro-2-methyl-2-(phenylmethoxycarbonylamino)propanoate Traditional Name: 2-(benzyloxycarbonylamino)-3-bromo-3,3-difluoro-2-methyl-propionic acid methyl ester Formula: C13H14BrF2NO4 MolecularWeight: 366.155366

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H14BrF2NO4/c1-12(10(18)20-2,13(14,15)16)17-11(19)21-8-9-6-4-3-5-7-9/h3-7H,8H2,1-2H3,(H,17,19)