3-(2,1,3-benzoxadiazol-5-ylcarbamoylamino)propanoic acid

Systemtic Name: 3-(2,1,3-benzoxadiazol-5-ylcarbamoylamino)propanoic acid Openeye Name: 3-(2,1,3-benzoxadiazol-5-ylcarbamoylamino)propanoic acid CAS Name: 3-[[(2,1,3-benzoxadiazol-5-ylamino)-oxomethyl]amino]propanoic acid IUPAC Name: 3-(2,1,3-benzoxadiazol-5-ylcarbamoylamino)propanoic acid Traditional Name: 3-(benzofurazan-5-ylcarbamoylamino)propionic acid Formula: C10H10N4O4 MolecularWeight: 250.2108

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=NON=C2C=C1NC(=O)NCCC(=O)O

Isomeric SMILES

C1=CC2=NON=C2C=C1NC(=O)NCCC(=O)O

InChI

InChI=1S/C10H10N4O4/c15-9(16)3-4-11-10(17)12-6-1-2-7-8(5-6)14-18-13-7/h1-2,5H,3-4H2,(H,15,16)(H2,11,12,17)