S-1,3-Dioxo-1H-benzisoquinoline-2(3H)-2'-propionic acid

(2S)-2-(1,3-dioxobenzo[de]isoquinolin-2-yl)propanoic acid

Also Known As: BAS 01368964|J2.140.275C|(2S)-2-(1,3-dioxobenzo[de]isoquinolin-2-yl)propanoic acid|S-1,3-Dioxo-1H-benzisoquinoline-2(3H)-2'-propionic acid|(2S)-2-(1,3-Dioxo-2,3-dihydro-1H-benzo[de]isoquinoline-2-yl)propanoic acid|(S)-2-(1,3-Dioxo-1,3-dihydro-2H-benzo[de]isoquinoline-2-yl)propionic acid|(S)-2-(1,3-Dioxo-2,3-dihydro-1H-benzo[de]isoquinoline-2-yl)propanoic acid|(S)-2-(1,3-Dioxo-2,3-dihydro-1H-benzo[de]isoquinoline-2-yl)propionic acid|(2S)-2-{2,4-dioxo-3-azatricyclo[7.3.1.05,13]trideca-1(13),5,7,9,11-pentaen-3-yl}propanoic acid

Molecular Formula	C15H11NO4
Molecular Weight	269.06882 g/mol
LogP	1.9089
Topological Polar Surface Area	74.68 Ų
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	3
Rotatable Bonds	2
Exact Mass	269.06882
Monoisotopic Mass	269.06882
Heavy Atoms	20
Complexity	714.8076

Chemical Identifiers

CAS Number	79444-35-2
SMILES	C[C@@H](C(=O)O)N1C(=O)C2=CC=CC3=C2C(=CC=C3)C1=O