5-oxidanylidene-5-[[3-(2-pyridin-2-ylethyl)phenyl]amino]pentanoic acid

Systemtic Name: 5-oxidanylidene-5-[[3-(2-pyridin-2-ylethyl)phenyl]amino]pentanoic acid Openeye Name: 5-oxo-5-[3-[2-(2-pyridyl)ethyl]anilino]pentanoic acid CAS Name: 5-oxo-5-[3-[2-(2-pyridinyl)ethyl]anilino]pentanoic acid IUPAC Name: 5-oxo-5-[3-(2-pyridin-2-ylethyl)anilino]pentanoic acid Traditional Name: 5-keto-5-[3-[2-(2-pyridyl)ethyl]anilino]valeric acid Formula: C18H20N2O3 MolecularWeight: 312.363

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)CCC2=CC(=CC=C2)NC(=O)CCCC(=O)O

Isomeric SMILES

C1=CC=NC(=C1)CCC2=CC(=CC=C2)NC(=O)CCCC(=O)O

InChI

InChI=1S/C18H20N2O3/c21-17(8-4-9-18(22)23)20-16-7-3-5-14(13-16)10-11-15-6-1-2-12-19-15/h1-3,5-7,12-13H,4,8-11H2,(H,20,21)(H,22,23)