3-[(4-azido-2-nitro-phenyl)amino]propanoic acid

Systemtic Name: 3-[(4-azido-2-nitro-phenyl)amino]propanoic acid Openeye Name: 3-(4-azido-2-nitro-anilino)propanoic acid CAS Name: 3-(4-azido-2-nitroanilino)propanoic acid IUPAC Name: 3-(4-azido-2-nitroanilino)propanoic acid Traditional Name: 3-(4-azido-2-nitro-anilino)propionic acid Formula: C9H9N5O4 MolecularWeight: 251.19886

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1N=[N+]=[N-])[N+](=O)[O-])NCCC(=O)O

Isomeric SMILES

C1=CC(=C(C=C1N=[N+]=[N-])[N+](=O)[O-])NCCC(=O)O

InChI

InChI=1S/C9H9N5O4/c10-13-12-6-1-2-7(8(5-6)14(17)18)11-4-3-9(15)16/h1-2,5,11H,3-4H2,(H,15,16)