3-[(4-nitro-2,1,3-benzoxadiazol-7-yl)amino]propanoic acid

Systemtic Name: 3-[(4-nitro-2,1,3-benzoxadiazol-7-yl)amino]propanoic acid Openeye Name: 3-[(4-nitro-2,1,3-benzoxadiazol-7-yl)amino]propanoic acid CAS Name: 3-[(4-nitro-2,1,3-benzoxadiazol-7-yl)amino]propanoic acid IUPAC Name: 3-[(4-nitro-2,1,3-benzoxadiazol-7-yl)amino]propanoic acid Traditional Name: 3-[(7-nitrobenzofurazan-4-yl)amino]propionic acid Formula: C9H8N4O5 MolecularWeight: 252.18362

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C2=NON=C2C(=C1)[N+](=O)[O-])NCCC(=O)O

Isomeric SMILES

C1=C(C2=NON=C2C(=C1)[N+](=O)[O-])NCCC(=O)O

InChI

InChI=1S/C9H8N4O5/c14-7(15)3-4-10-5-1-2-6(13(16)17)9-8(5)11-18-12-9/h1-2,10H,3-4H2,(H,14,15)