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

Systemtic Name: 2-[(4-cyano-2-nitro-phenyl)amino]propanoic acid Openeye Name: 2-(4-cyano-2-nitro-anilino)propanoic acid CAS Name: 2-(4-cyano-2-nitroanilino)propanoic acid IUPAC Name: 2-(4-cyano-2-nitroanilino)propanoic acid Traditional Name: 2-(4-cyano-2-nitro-anilino)propionic acid Formula: C10H9N3O4 MolecularWeight: 235.19616

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)NC1=C(C=C(C=C1)C#N)[N+](=O)[O-]

Isomeric SMILES

CC(C(=O)O)NC1=C(C=C(C=C1)C#N)[N+](=O)[O-]

InChI

InChI=1S/C10H9N3O4/c1-6(10(14)15)12-8-3-2-7(5-11)4-9(8)13(16)17/h2-4,6,12H,1H3,(H,14,15)