3-[[3,5-dimethyl-4-(2-methylquinolin-8-yl)oxy-phenyl]carbonylamino]propanoic acid

Systemtic Name: 3-[[3,5-dimethyl-4-(2-methylquinolin-8-yl)oxy-phenyl]carbonylamino]propanoic acid Openeye Name: 3-[[3,5-dimethyl-4-[(2-methyl-8-quinolyl)oxy]benzoyl]amino]propanoic acid CAS Name: 3-[[[3,5-dimethyl-4-[(2-methyl-8-quinolinyl)oxy]phenyl]-oxomethyl]amino]propanoic acid IUPAC Name: 3-[[3,5-dimethyl-4-(2-methylquinolin-8-yl)oxybenzoyl]amino]propanoic acid Traditional Name: 3-[[3,5-dimethyl-4-[(2-methyl-8-quinolyl)oxy]benzoyl]amino]propionic acid Formula: C22H22N2O4 MolecularWeight: 378.42108

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=CC=C2OC3=C(C=C(C=C3C)C(=O)NCCC(=O)O)C)C=C1

Isomeric SMILES

CC1=NC2=C(C=CC=C2OC3=C(C=C(C=C3C)C(=O)NCCC(=O)O)C)C=C1

InChI

InChI=1S/C22H22N2O4/c1-13-11-17(22(27)23-10-9-19(25)26)12-14(2)21(13)28-18-6-4-5-16-8-7-15(3)24-20(16)18/h4-8,11-12H,9-10H2,1-3H3,(H,23,27)(H,25,26)