3-[[(2,1,3-benzoxadiazol-5-ylamino)-(cyanoamino)methylidene]amino]propanoic acid

Systemtic Name: 3-[[(2,1,3-benzoxadiazol-5-ylamino)-(cyanoamino)methylidene]amino]propanoic acid Openeye Name: 3-[[(2,1,3-benzoxadiazol-5-ylamino)-(cyanoamino)methylene]amino]propanoic acid CAS Name: 3-[[(2,1,3-benzoxadiazol-5-ylamino)-(cyanoamino)methylidene]amino]propanoic acid IUPAC Name: 3-[[(2,1,3-benzoxadiazol-5-ylamino)-(cyanoamino)methylidene]amino]propanoic acid Traditional Name: 3-[[(benzofurazan-5-ylamino)-(cyanoamino)methylene]amino]propionic acid Formula: C11H10N6O3 MolecularWeight: 274.2355

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=NON=C2C=C1NC(=NCCC(=O)O)NC#N

Isomeric SMILES

C1=CC2=NON=C2C=C1NC(=NCCC(=O)O)NC#N

InChI

InChI=1S/C11H10N6O3/c12-6-14-11(13-4-3-10(18)19)15-7-1-2-8-9(5-7)17-20-16-8/h1-2,5H,3-4H2,(H,18,19)(H2,13,14,15)