5-(aminomethyl)furan-2-carboxylate; 2,2,2-tris(fluoranyl)ethanoate

Systemtic Name: 5-(aminomethyl)furan-2-carboxylate; 2,2,2-tris(fluoranyl)ethanoate Openeye Name: 5-(aminomethyl)furan-2-carboxylate; 2,2,2-trifluoroacetate CAS Name: 5-(aminomethyl)-2-furancarboxylate; 2,2,2-trifluoroacetate IUPAC Name: 5-(aminomethyl)furan-2-carboxylate; 2,2,2-trifluoroacetate Traditional Name: 5-(aminomethyl)-2-furoate; 2,2,2-trifluoroacetate Formula: C8H6F3NO5-2 MolecularWeight: 253.13215

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(OC(=C1)C(=O)[O-])CN.C(=O)(C(F)(F)F)[O-]

Isomeric SMILES

C1=C(OC(=C1)C(=O)[O-])CN.C(=O)(C(F)(F)F)[O-]

InChI

InChI=1S/C6H7NO3.C2HF3O2/c7-3-4-1-2-5(10-4)6(8)9;3-2(4,5)1(6)7/h1-2H,3,7H2,(H,8,9);(H,6,7)/p-2