3-[4-[2-(quinolin-2-ylcarbonylamino)ethyl]phenyl]propanoic acid

Systemtic Name: 3-[4-[2-(quinolin-2-ylcarbonylamino)ethyl]phenyl]propanoic acid Openeye Name: 3-[4-[2-(quinoline-2-carbonylamino)ethyl]phenyl]propanoic acid CAS Name: 3-[4-[2-[[oxo(2-quinolinyl)methyl]amino]ethyl]phenyl]propanoic acid IUPAC Name: 3-[4-[2-(quinoline-2-carbonylamino)ethyl]phenyl]propanoic acid Traditional Name: 3-[4-[2-(quinaldoylamino)ethyl]phenyl]propionic acid Formula: C21H20N2O3 MolecularWeight: 348.3951

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=N2)C(=O)NCCC3=CC=C(C=C3)CCC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=N2)C(=O)NCCC3=CC=C(C=C3)CCC(=O)O

InChI

InChI=1S/C21H20N2O3/c24-20(25)12-9-15-5-7-16(8-6-15)13-14-22-21(26)19-11-10-17-3-1-2-4-18(17)23-19/h1-8,10-11H,9,12-14H2,(H,22,26)(H,24,25)