2-(4-chloranyl-2,6-dinitro-phenyl)ethanoic acid

Systemtic Name: 2-(4-chloranyl-2,6-dinitro-phenyl)ethanoic acid Openeye Name: 2-(4-chloro-2,6-dinitro-phenyl)acetic acid CAS Name: 2-(4-chloro-2,6-dinitrophenyl)acetic acid IUPAC Name: 2-(4-chloro-2,6-dinitrophenyl)acetic acid Traditional Name: 2-(4-chloro-2,6-dinitro-phenyl)acetic acid Formula: C8H5ClN2O6 MolecularWeight: 260.5881

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H5ClN2O6/c9-4-1-6(10(14)15)5(3-8(12)13)7(2-4)11(16)17/h1-2H,3H2,(H,12,13)