6-oxidanylidene-6-(1-pyridin-4-ylethylamino)hexanoic acid

Systemtic Name: 6-oxidanylidene-6-(1-pyridin-4-ylethylamino)hexanoic acid Openeye Name: 6-oxo-6-[1-(4-pyridyl)ethylamino]hexanoic acid CAS Name: 6-oxo-6-(1-pyridin-4-ylethylamino)hexanoic acid IUPAC Name: 6-oxo-6-(1-pyridin-4-ylethylamino)hexanoic acid Traditional Name: 6-keto-6-[1-(4-pyridyl)ethylamino]hexanoic acid Formula: C13H18N2O3 MolecularWeight: 250.29362

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=NC=C1)NC(=O)CCCCC(=O)O

Isomeric SMILES

CC(C1=CC=NC=C1)NC(=O)CCCCC(=O)O

InChI

InChI=1S/C13H18N2O3/c1-10(11-6-8-14-9-7-11)15-12(16)4-2-3-5-13(17)18/h6-10H,2-5H2,1H3,(H,15,16)(H,17,18)