sodium ethyl 2-nitro-2-(4-nitro-2,1,3-benzothiadiazol-7-yl)ethanoate

Systemtic Name: sodium ethyl 2-nitro-2-(4-nitro-2,1,3-benzothiadiazol-7-yl)ethanoate Openeye Name: sodium ethyl 2-nitro-2-(4-nitro-2,1,3-benzothiadiazol-7-yl)acetate CAS Name: sodium 2-nitro-2-(4-nitro-2,1,3-benzothiadiazol-7-yl)acetic acid ethyl ester IUPAC Name: sodium ethyl 2-nitro-2-(4-nitro-2,1,3-benzothiadiazol-7-yl)acetate Traditional Name: sodium 2-nitro-2-(7-nitropiazthiol-4-yl)acetic acid ethyl ester Formula: C10H8N4NaO6S+ MolecularWeight: 335.24849

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1=CC=C(C2=NSN=C12)[N+](=O)[O-])[N+](=O)[O-].[Na+]

Isomeric SMILES

CCOC(=O)C(C1=CC=C(C2=NSN=C12)[N+](=O)[O-])[N+](=O)[O-].[Na+]

InChI

InChI=1S/C10H8N4O6S.Na/c1-2-20-10(15)9(14(18)19)5-3-4-6(13(16)17)8-7(5)11-21-12-8;/h3-4,9H,2H2,1H3;/q;+1