[(2R)-1-(tert-butylamino)-1-oxidanylidene-propan-2-yl] (E)-3-(5-bromanyl-2-fluoranyl-phenyl)prop-2-enoate

Systemtic Name: [(2R)-1-(tert-butylamino)-1-oxidanylidene-propan-2-yl] (E)-3-(5-bromanyl-2-fluoranyl-phenyl)prop-2-enoate Openeye Name: [(1R)-2-(tert-butylamino)-1-methyl-2-oxo-ethyl] (E)-3-(5-bromo-2-fluoro-phenyl)prop-2-enoate CAS Name: (E)-3-(5-bromo-2-fluorophenyl)-2-propenoic acid [(2R)-1-(tert-butylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(tert-butylamino)-1-oxopropan-2-yl] (E)-3-(5-bromo-2-fluorophenyl)prop-2-enoate Traditional Name: (E)-3-(5-bromo-2-fluoro-phenyl)acrylic acid [(1R)-2-(tert-butylamino)-2-keto-1-methyl-ethyl] ester Formula: C16H19BrFNO3 MolecularWeight: 372.229363

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(C)(C)C)OC(=O)C=CC1=C(C=CC(=C1)Br)F

Isomeric SMILES

C[C@H](C(=O)NC(C)(C)C)OC(=O)/C=C/C1=C(C=CC(=C1)Br)F

InChI

InChI=1S/C16H19BrFNO3/c1-10(15(21)19-16(2,3)4)22-14(20)8-5-11-9-12(17)6-7-13(11)18/h5-10H,1-4H3,(H,19,21)/b8-5+/t10-/m1/s1