3-[2-methyl-4-[(5-methyl-2-oxidanyl-phenyl)amino]quinolin-3-yl]propanoic acid

Systemtic Name: 3-[2-methyl-4-[(5-methyl-2-oxidanyl-phenyl)amino]quinolin-3-yl]propanoic acid Openeye Name: 3-[4-(2-hydroxy-5-methyl-anilino)-2-methyl-3-quinolyl]propanoic acid CAS Name: 3-[4-(2-hydroxy-5-methylanilino)-2-methyl-3-quinolinyl]propanoic acid IUPAC Name: 3-[4-(2-hydroxy-5-methylanilino)-2-methylquinolin-3-yl]propanoic acid Traditional Name: 3-[4-(2-hydroxy-5-methyl-anilino)-2-methyl-3-quinolyl]propionic acid Formula: C20H20N2O3 MolecularWeight: 336.3844

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)O)NC2=C(C(=NC3=CC=CC=C32)C)CCC(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)O)NC2=C(C(=NC3=CC=CC=C32)C)CCC(=O)O

InChI

InChI=1S/C20H20N2O3/c1-12-7-9-18(23)17(11-12)22-20-14(8-10-19(24)25)13(2)21-16-6-4-3-5-15(16)20/h3-7,9,11,23H,8,10H2,1-2H3,(H,21,22)(H,24,25)