2-[2-(2-methoxy-4-methyl-phenoxy)ethanoylamino]terephthalic acid

Systemtic Name: 2-[2-(2-methoxy-4-methyl-phenoxy)ethanoylamino]terephthalic acid Openeye Name: 2-[[2-(2-methoxy-4-methyl-phenoxy)acetyl]amino]terephthalic acid CAS Name: 2-[[2-(2-methoxy-4-methylphenoxy)-1-oxoethyl]amino]terephthalic acid IUPAC Name: 2-[[2-(2-methoxy-4-methylphenoxy)acetyl]amino]terephthalic acid Traditional Name: 2-[[2-(2-methoxy-4-methyl-phenoxy)acetyl]amino]terephthalic acid Formula: C18H17NO7 MolecularWeight: 359.33008

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCC(=O)NC2=C(C=CC(=C2)C(=O)O)C(=O)O)OC

Isomeric SMILES

CC1=CC(=C(C=C1)OCC(=O)NC2=C(C=CC(=C2)C(=O)O)C(=O)O)OC

InChI

InChI=1S/C18H17NO7/c1-10-3-6-14(15(7-10)25-2)26-9-16(20)19-13-8-11(17(21)22)4-5-12(13)18(23)24/h3-8H,9H2,1-2H3,(H,19,20)(H,21,22)(H,23,24)