2-cyano-2-(4-cyano-2-nitro-phenyl)ethanoic acid

Systemtic Name: 2-cyano-2-(4-cyano-2-nitro-phenyl)ethanoic acid Openeye Name: 2-cyano-2-(4-cyano-2-nitro-phenyl)acetic acid CAS Name: 2-cyano-2-(4-cyano-2-nitrophenyl)acetic acid IUPAC Name: 2-cyano-2-(4-cyano-2-nitrophenyl)acetic acid Traditional Name: 2-cyano-2-(4-cyano-2-nitro-phenyl)acetic acid Formula: C10H5N3O4 MolecularWeight: 231.1644

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C#N)[N+](=O)[O-])C(C#N)C(=O)O

Isomeric SMILES

C1=CC(=C(C=C1C#N)[N+](=O)[O-])C(C#N)C(=O)O

InChI

InChI=1S/C10H5N3O4/c11-4-6-1-2-7(8(5-12)10(14)15)9(3-6)13(16)17/h1-3,8H,(H,14,15)