2-[3-(4-ethylphenyl)propanoylamino]terephthalic acid

Systemtic Name: 2-[3-(4-ethylphenyl)propanoylamino]terephthalic acid Openeye Name: 2-[3-(4-ethylphenyl)propanoylamino]terephthalic acid CAS Name: 2-[[3-(4-ethylphenyl)-1-oxopropyl]amino]terephthalic acid IUPAC Name: 2-[3-(4-ethylphenyl)propanoylamino]terephthalic acid Traditional Name: 2-[3-(4-ethylphenyl)propanoylamino]terephthalic acid Formula: C19H19NO5 MolecularWeight: 341.35786

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CCC(=O)NC2=C(C=CC(=C2)C(=O)O)C(=O)O

Isomeric SMILES

CCC1=CC=C(C=C1)CCC(=O)NC2=C(C=CC(=C2)C(=O)O)C(=O)O

InChI

InChI=1S/C19H19NO5/c1-2-12-3-5-13(6-4-12)7-10-17(21)20-16-11-14(18(22)23)8-9-15(16)19(24)25/h3-6,8-9,11H,2,7,10H2,1H3,(H,20,21)(H,22,23)(H,24,25)