3-[4-[2-[(2-methylquinolin-8-yl)carbonylamino]ethyl]phenyl]propanoic acid

Systemtic Name: 3-[4-[2-[(2-methylquinolin-8-yl)carbonylamino]ethyl]phenyl]propanoic acid Openeye Name: 3-[4-[2-[(2-methylquinoline-8-carbonyl)amino]ethyl]phenyl]propanoic acid CAS Name: 3-[4-[2-[[(2-methyl-8-quinolinyl)-oxomethyl]amino]ethyl]phenyl]propanoic acid IUPAC Name: 3-[4-[2-[(2-methylquinoline-8-carbonyl)amino]ethyl]phenyl]propanoic acid Traditional Name: 3-[4-[2-[(2-methylquinoline-8-carbonyl)amino]ethyl]phenyl]propionic acid Formula: C22H22N2O3 MolecularWeight: 362.42168

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=CC=C2C(=O)NCCC3=CC=C(C=C3)CCC(=O)O)C=C1

Isomeric SMILES

CC1=NC2=C(C=CC=C2C(=O)NCCC3=CC=C(C=C3)CCC(=O)O)C=C1

InChI

InChI=1S/C22H22N2O3/c1-15-5-11-18-3-2-4-19(21(18)24-15)22(27)23-14-13-17-8-6-16(7-9-17)10-12-20(25)26/h2-9,11H,10,12-14H2,1H3,(H,23,27)(H,25,26)