3-[3,5-dimethyl-2-(pyridin-3-ylcarbamoyl)phenyl]-2,2-dimethyl-propanoic acid

Systemtic Name: 3-[3,5-dimethyl-2-(pyridin-3-ylcarbamoyl)phenyl]-2,2-dimethyl-propanoic acid Openeye Name: 3-[3,5-dimethyl-2-(3-pyridylcarbamoyl)phenyl]-2,2-dimethyl-propanoic acid CAS Name: 3-[3,5-dimethyl-2-[oxo-(3-pyridinylamino)methyl]phenyl]-2,2-dimethylpropanoic acid IUPAC Name: 3-[3,5-dimethyl-2-(pyridin-3-ylcarbamoyl)phenyl]-2,2-dimethylpropanoic acid Traditional Name: 3-[3,5-dimethyl-2-(3-pyridylcarbamoyl)phenyl]-2,2-dimethyl-propionic acid Formula: C19H22N2O3 MolecularWeight: 326.38958

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)CC(C)(C)C(=O)O)C(=O)NC2=CN=CC=C2)C

Isomeric SMILES

CC1=CC(=C(C(=C1)CC(C)(C)C(=O)O)C(=O)NC2=CN=CC=C2)C

InChI

InChI=1S/C19H22N2O3/c1-12-8-13(2)16(14(9-12)10-19(3,4)18(23)24)17(22)21-15-6-5-7-20-11-15/h5-9,11H,10H2,1-4H3,(H,21,22)(H,23,24)