4,4,4-tris(fluoranyl)-3-(phenylmethoxycarbonylamino)butanoic acid

Systemtic Name: 4,4,4-tris(fluoranyl)-3-(phenylmethoxycarbonylamino)butanoic acid Openeye Name: 3-(benzyloxycarbonylamino)-4,4,4-trifluoro-butanoic acid CAS Name: 4,4,4-trifluoro-3-(phenylmethoxycarbonylamino)butanoic acid IUPAC Name: 4,4,4-trifluoro-3-(phenylmethoxycarbonylamino)butanoic acid Traditional Name: 3-(benzyloxycarbonylamino)-4,4,4-trifluoro-butyric acid Formula: C12H12F3NO4 MolecularWeight: 291.22319

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H12F3NO4/c13-12(14,15)9(6-10(17)18)16-11(19)20-7-8-4-2-1-3-5-8/h1-5,9H,6-7H2,(H,16,19)(H,17,18)