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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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