2-[6-chloranyl-2-oxidanylidene-3-(2-pyridin-2-ylethylamino)pyrazin-1-yl]ethanoic acid

Systemtic Name: 2-[6-chloranyl-2-oxidanylidene-3-(2-pyridin-2-ylethylamino)pyrazin-1-yl]ethanoic acid Openeye Name: 2-[6-chloro-2-oxo-3-[2-(2-pyridyl)ethylamino]pyrazin-1-yl]acetic acid CAS Name: 2-[6-chloro-2-oxo-3-[2-(2-pyridinyl)ethylamino]-1-pyrazinyl]acetic acid IUPAC Name: 2-[6-chloro-2-oxo-3-(2-pyridin-2-ylethylamino)pyrazin-1-yl]acetic acid Traditional Name: 2-[6-chloro-2-keto-3-[2-(2-pyridyl)ethylamino]pyrazin-1-yl]acetic acid Formula: C13H13ClN4O3 MolecularWeight: 308.72032

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)CCNC2=NC=C(N(C2=O)CC(=O)O)Cl

Isomeric SMILES

C1=CC=NC(=C1)CCNC2=NC=C(N(C2=O)CC(=O)O)Cl

InChI

InChI=1S/C13H13ClN4O3/c14-10-7-17-12(13(21)18(10)8-11(19)20)16-6-4-9-3-1-2-5-15-9/h1-3,5,7H,4,6,8H2,(H,16,17)(H,19,20)