2-[3-(2-fluoranylphenoxy)propanoylamino]terephthalic acid

Systemtic Name: 2-[3-(2-fluoranylphenoxy)propanoylamino]terephthalic acid Openeye Name: 2-[3-(2-fluorophenoxy)propanoylamino]terephthalic acid CAS Name: 2-[[3-(2-fluorophenoxy)-1-oxopropyl]amino]terephthalic acid IUPAC Name: 2-[3-(2-fluorophenoxy)propanoylamino]terephthalic acid Traditional Name: 2-[3-(2-fluorophenoxy)propanoylamino]terephthalic acid Formula: C17H14FNO6 MolecularWeight: 347.294563

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)OCCC(=O)NC2=C(C=CC(=C2)C(=O)O)C(=O)O)F

Isomeric SMILES

C1=CC=C(C(=C1)OCCC(=O)NC2=C(C=CC(=C2)C(=O)O)C(=O)O)F

InChI

InChI=1S/C17H14FNO6/c18-12-3-1-2-4-14(12)25-8-7-15(20)19-13-9-10(16(21)22)5-6-11(13)17(23)24/h1-6,9H,7-8H2,(H,19,20)(H,21,22)(H,23,24)