3,4,4-tris(fluoranyl)-2-(phenylmethoxycarbonylamino)but-3-enoic acid

Systemtic Name: 3,4,4-tris(fluoranyl)-2-(phenylmethoxycarbonylamino)but-3-enoic acid Openeye Name: 2-(benzyloxycarbonylamino)-3,4,4-trifluoro-but-3-enoic acid CAS Name: 3,4,4-trifluoro-2-(phenylmethoxycarbonylamino)-3-butenoic acid IUPAC Name: 3,4,4-trifluoro-2-(phenylmethoxycarbonylamino)but-3-enoic acid Traditional Name: 2-(benzyloxycarbonylamino)-3,4,4-trifluoro-but-3-enoic acid Formula: C12H10F3NO4 MolecularWeight: 289.20731

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NC(C(=C(F)F)F)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NC(C(=C(F)F)F)C(=O)O

InChI

InChI=1S/C12H10F3NO4/c13-8(10(14)15)9(11(17)18)16-12(19)20-6-7-4-2-1-3-5-7/h1-5,9H,6H2,(H,16,19)(H,17,18)