2-[3-[6-(carboxymethyloxy)naphthalen-2-yl]propanoylamino]benzoic acid

Systemtic Name: 2-[3-[6-(carboxymethyloxy)naphthalen-2-yl]propanoylamino]benzoic acid Openeye Name: 2-[3-[6-(carboxymethyloxy)-2-naphthyl]propanoylamino]benzoic acid CAS Name: 2-[[3-[6-(carboxymethyloxy)-2-naphthalenyl]-1-oxopropyl]amino]benzoic acid IUPAC Name: 2-[3-[6-(carboxymethyloxy)naphthalen-2-yl]propanoylamino]benzoic acid Traditional Name: 2-[3-[6-(carboxymethyloxy)-2-naphthyl]propanoylamino]benzoic acid Formula: C22H19NO6 MolecularWeight: 393.38936

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)O)NC(=O)CCC2=CC3=C(C=C2)C=C(C=C3)OCC(=O)O

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)O)NC(=O)CCC2=CC3=C(C=C2)C=C(C=C3)OCC(=O)O

InChI

InChI=1S/C22H19NO6/c24-20(23-19-4-2-1-3-18(19)22(27)28)10-6-14-5-7-16-12-17(29-13-21(25)26)9-8-15(16)11-14/h1-5,7-9,11-12H,6,10,13H2,(H,23,24)(H,25,26)(H,27,28)