2,2-bis(fluoranyl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-3-thiophen-2-yl-propanoic acid

Systemtic Name: 2,2-bis(fluoranyl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-3-thiophen-2-yl-propanoic acid Openeye Name: 3-(tert-butoxycarbonylamino)-2,2-difluoro-3-(2-thienyl)propanoic acid CAS Name: 2,2-difluoro-3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-thiophen-2-ylpropanoic acid IUPAC Name: 2,2-difluoro-3-[(2-methylpropan-2-yl)oxycarbonylamino]-3-thiophen-2-ylpropanoic acid Traditional Name: 3-(tert-butoxycarbonylamino)-2,2-difluoro-3-(2-thienyl)propionic acid Formula: C12H15F2NO4S MolecularWeight: 307.313606

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(C1=CC=CS1)C(C(=O)O)(F)F

Isomeric SMILES

CC(C)(C)OC(=O)NC(C1=CC=CS1)C(C(=O)O)(F)F

InChI

InChI=1S/C12H15F2NO4S/c1-11(2,3)19-10(18)15-8(7-5-4-6-20-7)12(13,14)9(16)17/h4-6,8H,1-3H3,(H,15,18)(H,16,17)