3-[3-cyano-4-(dimethylamino)phenyl]-2-methyl-propanoic acid

Systemtic Name: 3-[3-cyano-4-(dimethylamino)phenyl]-2-methyl-propanoic acid Openeye Name: 3-[3-cyano-4-(dimethylamino)phenyl]-2-methyl-propanoic acid CAS Name: 3-[3-cyano-4-(dimethylamino)phenyl]-2-methylpropanoic acid IUPAC Name: 3-[3-cyano-4-(dimethylamino)phenyl]-2-methylpropanoic acid Traditional Name: 3-[3-cyano-4-(dimethylamino)phenyl]-2-methyl-propionic acid Formula: C13H16N2O2 MolecularWeight: 232.27834

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC(=C(C=C1)N(C)C)C#N)C(=O)O

Isomeric SMILES

CC(CC1=CC(=C(C=C1)N(C)C)C#N)C(=O)O

InChI

InChI=1S/C13H16N2O2/c1-9(13(16)17)6-10-4-5-12(15(2)3)11(7-10)8-14/h4-5,7,9H,6H2,1-3H3,(H,16,17)