2-[4-[2-(quinolin-8-ylcarbonylamino)ethyl]phenyl]propanoic acid

Systemtic Name: 2-[4-[2-(quinolin-8-ylcarbonylamino)ethyl]phenyl]propanoic acid Openeye Name: 2-[4-[2-(quinoline-8-carbonylamino)ethyl]phenyl]propanoic acid CAS Name: 2-[4-[2-[[oxo(8-quinolinyl)methyl]amino]ethyl]phenyl]propanoic acid IUPAC Name: 2-[4-[2-(quinoline-8-carbonylamino)ethyl]phenyl]propanoic acid Traditional Name: 2-[4-[2-(quinoline-8-carbonylamino)ethyl]phenyl]propionic acid Formula: C21H20N2O3 MolecularWeight: 348.3951

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)CCNC(=O)C2=CC=CC3=C2N=CC=C3)C(=O)O

Isomeric SMILES

CC(C1=CC=C(C=C1)CCNC(=O)C2=CC=CC3=C2N=CC=C3)C(=O)O

InChI

InChI=1S/C21H20N2O3/c1-14(21(25)26)16-9-7-15(8-10-16)11-13-23-20(24)18-6-2-4-17-5-3-12-22-19(17)18/h2-10,12,14H,11,13H2,1H3,(H,23,24)(H,25,26)