5-[2-(3-chloranylphenoxy)propanoylamino]benzene-1,3-dicarboxylic acid

Systemtic Name: 5-[2-(3-chloranylphenoxy)propanoylamino]benzene-1,3-dicarboxylic acid Openeye Name: 5-[2-(3-chlorophenoxy)propanoylamino]benzene-1,3-dicarboxylic acid CAS Name: 5-[[2-(3-chlorophenoxy)-1-oxopropyl]amino]benzene-1,3-dicarboxylic acid IUPAC Name: 5-[2-(3-chlorophenoxy)propanoylamino]benzene-1,3-dicarboxylic acid Traditional Name: 5-[2-(3-chlorophenoxy)propanoylamino]isophthalic acid Formula: C17H14ClNO6 MolecularWeight: 363.74916

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H14ClNO6/c1-9(25-14-4-2-3-12(18)8-14)15(20)19-13-6-10(16(21)22)5-11(7-13)17(23)24/h2-9H,1H3,(H,19,20)(H,21,22)(H,23,24)