2-[2-[2,4-bis(chloranyl)phenoxy]propanoylamino]terephthalic acid

Systemtic Name: 2-[2-[2,4-bis(chloranyl)phenoxy]propanoylamino]terephthalic acid Openeye Name: 2-[2-(2,4-dichlorophenoxy)propanoylamino]terephthalic acid CAS Name: 2-[[2-(2,4-dichlorophenoxy)-1-oxopropyl]amino]terephthalic acid IUPAC Name: 2-[2-(2,4-dichlorophenoxy)propanoylamino]terephthalic acid Traditional Name: 2-[2-(2,4-dichlorophenoxy)propanoylamino]terephthalic acid Formula: C17H13Cl2NO6 MolecularWeight: 398.19422

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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=C(C=C(C=C2)Cl)Cl

Isomeric SMILES

CC(C(=O)NC1=C(C=CC(=C1)C(=O)O)C(=O)O)OC2=C(C=C(C=C2)Cl)Cl

InChI

InChI=1S/C17H13Cl2NO6/c1-8(26-14-5-3-10(18)7-12(14)19)15(21)20-13-6-9(16(22)23)2-4-11(13)17(24)25/h2-8H,1H3,(H,20,21)(H,22,23)(H,24,25)