sodium 5-(chloromethyl)-2-nitro-benzoate

Systemtic Name: sodium 5-(chloromethyl)-2-nitro-benzoate Openeye Name: sodium 5-(chloromethyl)-2-nitro-benzoate CAS Name: sodium 5-(chloromethyl)-2-nitrobenzoate IUPAC Name: sodium 5-(chloromethyl)-2-nitrobenzoate Traditional Name: sodium 5-(chloromethyl)-2-nitro-benzoate Formula: C8H5ClNNaO4 MolecularWeight: 237.57237

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1CCl)C(=O)[O-])[N+](=O)[O-].[Na+]

Isomeric SMILES

C1=CC(=C(C=C1CCl)C(=O)[O-])[N+](=O)[O-].[Na+]

InChI

InChI=1S/C8H6ClNO4.Na/c9-4-5-1-2-7(10(13)14)6(3-5)8(11)12;/h1-3H,4H2,(H,11,12);/q;+1/p-1