2,2-dimethyl-3-[4-[(2-methylquinolin-4-yl)methoxy]phenyl]-3-oxidanylidene-propanoic acid

Systemtic Name: 2,2-dimethyl-3-[4-[(2-methylquinolin-4-yl)methoxy]phenyl]-3-oxidanylidene-propanoic acid Openeye Name: 2,2-dimethyl-3-[4-[(2-methyl-4-quinolyl)methoxy]phenyl]-3-oxo-propanoic acid CAS Name: 2,2-dimethyl-3-[4-[(2-methyl-4-quinolinyl)methoxy]phenyl]-3-oxopropanoic acid IUPAC Name: 2,2-dimethyl-3-[4-[(2-methylquinolin-4-yl)methoxy]phenyl]-3-oxopropanoic acid Traditional Name: 3-keto-2,2-dimethyl-3-[4-[(2-methyl-4-quinolyl)methoxy]phenyl]propionic acid Formula: C22H21NO4 MolecularWeight: 363.40644

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=C1)COC3=CC=C(C=C3)C(=O)C(C)(C)C(=O)O

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=C1)COC3=CC=C(C=C3)C(=O)C(C)(C)C(=O)O

InChI

InChI=1S/C22H21NO4/c1-14-12-16(18-6-4-5-7-19(18)23-14)13-27-17-10-8-15(9-11-17)20(24)22(2,3)21(25)26/h4-12H,13H2,1-3H3,(H,25,26)