2-[2-(4-cyanophenoxy)propanoylamino]terephthalic acid

Systemtic Name: 2-[2-(4-cyanophenoxy)propanoylamino]terephthalic acid Openeye Name: 2-[2-(4-cyanophenoxy)propanoylamino]terephthalic acid CAS Name: 2-[[2-(4-cyanophenoxy)-1-oxopropyl]amino]terephthalic acid IUPAC Name: 2-[2-(4-cyanophenoxy)propanoylamino]terephthalic acid Traditional Name: 2-[2-(4-cyanophenoxy)propanoylamino]terephthalic acid Formula: C18H14N2O6 MolecularWeight: 354.31356

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=CC(=C1)C(=O)O)C(=O)O)OC2=CC=C(C=C2)C#N

Isomeric SMILES

CC(C(=O)NC1=C(C=CC(=C1)C(=O)O)C(=O)O)OC2=CC=C(C=C2)C#N

InChI

InChI=1S/C18H14N2O6/c1-10(26-13-5-2-11(9-19)3-6-13)16(21)20-15-8-12(17(22)23)4-7-14(15)18(24)25/h2-8,10H,1H3,(H,20,21)(H,22,23)(H,24,25)