2-[2-(4-chloranylnaphthalen-1-yl)oxyethanoylamino]terephthalic acid

Systemtic Name: 2-[2-(4-chloranylnaphthalen-1-yl)oxyethanoylamino]terephthalic acid Openeye Name: 2-[[2-[(4-chloro-1-naphthyl)oxy]acetyl]amino]terephthalic acid CAS Name: 2-[[2-[(4-chloro-1-naphthalenyl)oxy]-1-oxoethyl]amino]terephthalic acid IUPAC Name: 2-[[2-(4-chloronaphthalen-1-yl)oxyacetyl]amino]terephthalic acid Traditional Name: 2-[[2-(4-chloro-1-naphthoxy)acetyl]amino]terephthalic acid Formula: C20H14ClNO6 MolecularWeight: 399.78126

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC=C2Cl)OCC(=O)NC3=C(C=CC(=C3)C(=O)O)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC=C2Cl)OCC(=O)NC3=C(C=CC(=C3)C(=O)O)C(=O)O

InChI

InChI=1S/C20H14ClNO6/c21-15-7-8-17(13-4-2-1-3-12(13)15)28-10-18(23)22-16-9-11(19(24)25)5-6-14(16)20(26)27/h1-9H,10H2,(H,22,23)(H,24,25)(H,26,27)