2-[3-(4-pyridin-2-ylphenyl)propanoylamino]benzoic acid

Systemtic Name: 2-[3-(4-pyridin-2-ylphenyl)propanoylamino]benzoic acid Openeye Name: 2-[3-[4-(2-pyridyl)phenyl]propanoylamino]benzoic acid CAS Name: 2-[[1-oxo-3-[4-(2-pyridinyl)phenyl]propyl]amino]benzoic acid IUPAC Name: 2-[3-(4-pyridin-2-ylphenyl)propanoylamino]benzoic acid Traditional Name: 2-[3-[4-(2-pyridyl)phenyl]propanoylamino]benzoic acid Formula: C21H18N2O3 MolecularWeight: 346.37922

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)O)NC(=O)CCC2=CC=C(C=C2)C3=CC=CC=N3

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)O)NC(=O)CCC2=CC=C(C=C2)C3=CC=CC=N3

InChI

InChI=1S/C21H18N2O3/c24-20(23-19-7-2-1-5-17(19)21(25)26)13-10-15-8-11-16(12-9-15)18-6-3-4-14-22-18/h1-9,11-12,14H,10,13H2,(H,23,24)(H,25,26)