2-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]propanoic acid

Systemtic Name: 2-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]propanoic acid Openeye Name: 2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]propanoic acid CAS Name: 2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]propanoic acid IUPAC Name: 2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]propanoic acid Traditional Name: 2-[(1,1-diketo-1,2-benzothiazol-3-yl)amino]propionic acid Formula: C10H10N2O4S MolecularWeight: 254.2624

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)NC1=NS(=O)(=O)C2=CC=CC=C21

Isomeric SMILES

CC(C(=O)O)NC1=NS(=O)(=O)C2=CC=CC=C21

InChI

InChI=1S/C10H10N2O4S/c1-6(10(13)14)11-9-7-4-2-3-5-8(7)17(15,16)12-9/h2-6H,1H3,(H,11,12)(H,13,14)