4-chloranyl-3,5-dinitro-benzoic acid

Systemtic Name: 4-chloranyl-3,5-dinitro-benzoic acid Openeye Name: 4-chloro-3,5-dinitro-benzoic acid CAS Name: 4-chloro-3,5-dinitrobenzoic acid IUPAC Name: 4-chloro-3,5-dinitrobenzoic acid Traditional Name: 4-chloro-3,5-dinitro-benzoic acid Formula: C7H3ClN2O6 MolecularWeight: 246.56152

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C7H3ClN2O6/c8-6-4(9(13)14)1-3(7(11)12)2-5(6)10(15)16/h1-2H,(H,11,12)