2-[[6-(dimethylaminomethyl)pyridin-3-yl]methyl]-3-oxidanylidene-propanoic acid

Systemtic Name: 2-[[6-(dimethylaminomethyl)pyridin-3-yl]methyl]-3-oxidanylidene-propanoic acid Openeye Name: 2-[[6-(dimethylaminomethyl)-3-pyridyl]methyl]-3-oxo-propanoic acid CAS Name: 2-[[6-(dimethylaminomethyl)-3-pyridinyl]methyl]-3-oxopropanoic acid IUPAC Name: 2-[[6-(dimethylaminomethyl)pyridin-3-yl]methyl]-3-oxopropanoic acid Traditional Name: 2-[[6-(dimethylaminomethyl)-3-pyridyl]methyl]-3-keto-propionic acid Formula: C12H16N2O3 MolecularWeight: 236.26704

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1=NC=C(C=C1)CC(C=O)C(=O)O

Isomeric SMILES

CN(C)CC1=NC=C(C=C1)CC(C=O)C(=O)O

InChI

InChI=1S/C12H16N2O3/c1-14(2)7-11-4-3-9(6-13-11)5-10(8-15)12(16)17/h3-4,6,8,10H,5,7H2,1-2H3,(H,16,17)