methyl 5-chloranyl-2,4-dinitro-benzoate

Systemtic Name: methyl 5-chloranyl-2,4-dinitro-benzoate Openeye Name: methyl 5-chloro-2,4-dinitro-benzoate CAS Name: 5-chloro-2,4-dinitrobenzoic acid methyl ester IUPAC Name: methyl 5-chloro-2,4-dinitrobenzoate Traditional Name: 5-chloro-2,4-dinitro-benzoic acid methyl ester Formula: C8H5ClN2O6 MolecularWeight: 260.5881

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H5ClN2O6/c1-17-8(12)4-2-5(9)7(11(15)16)3-6(4)10(13)14/h2-3H,1H3