5-[[methyl(pyridin-4-ylmethyl)amino]methyl]furan-2-carboxylic acid

Systemtic Name: 5-[[methyl(pyridin-4-ylmethyl)amino]methyl]furan-2-carboxylic acid Openeye Name: 5-[[methyl(4-pyridylmethyl)amino]methyl]furan-2-carboxylic acid CAS Name: 5-[[methyl(pyridin-4-ylmethyl)amino]methyl]-2-furancarboxylic acid IUPAC Name: 5-[[methyl(pyridin-4-ylmethyl)amino]methyl]furan-2-carboxylic acid Traditional Name: 5-[[methyl(4-pyridylmethyl)amino]methyl]-2-furoic acid Formula: C13H14N2O3 MolecularWeight: 246.26186

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=NC=C1)CC2=CC=C(O2)C(=O)O

Isomeric SMILES

CN(CC1=CC=NC=C1)CC2=CC=C(O2)C(=O)O

InChI

InChI=1S/C13H14N2O3/c1-15(8-10-4-6-14-7-5-10)9-11-2-3-12(18-11)13(16)17/h2-7H,8-9H2,1H3,(H,16,17)