2-[4-(4-ethoxyphenoxy)butanoylamino]terephthalic acid

Systemtic Name: 2-[4-(4-ethoxyphenoxy)butanoylamino]terephthalic acid Openeye Name: 2-[4-(4-ethoxyphenoxy)butanoylamino]terephthalic acid CAS Name: 2-[[4-(4-ethoxyphenoxy)-1-oxobutyl]amino]terephthalic acid IUPAC Name: 2-[4-(4-ethoxyphenoxy)butanoylamino]terephthalic acid Traditional Name: 2-[4-(4-ethoxyphenoxy)butanoylamino]terephthalic acid Formula: C20H21NO7 MolecularWeight: 387.38324

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)OCCCC(=O)NC2=C(C=CC(=C2)C(=O)O)C(=O)O

Isomeric SMILES

CCOC1=CC=C(C=C1)OCCCC(=O)NC2=C(C=CC(=C2)C(=O)O)C(=O)O

InChI

InChI=1S/C20H21NO7/c1-2-27-14-6-8-15(9-7-14)28-11-3-4-18(22)21-17-12-13(19(23)24)5-10-16(17)20(25)26/h5-10,12H,2-4,11H2,1H3,(H,21,22)(H,23,24)(H,25,26)