sodium 2,4-dinitronaphthalen-1-olate hydrate

Systemtic Name: sodium 2,4-dinitronaphthalen-1-olate hydrate Openeye Name: sodium 2,4-dinitronaphthalen-1-olate hydrate CAS Name: sodium 2,4-dinitro-1-naphthalenolate hydrate IUPAC Name: sodium 2,4-dinitronaphthalen-1-olate hydrate Traditional Name: sodium 2,4-dinitronaphthalen-1-olate hydrate Formula: C10H7N2NaO6 MolecularWeight: 274.16215

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC(=C2[O-])[N+](=O)[O-])[N+](=O)[O-].O.[Na+]

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC(=C2[O-])[N+](=O)[O-])[N+](=O)[O-].O.[Na+]

InChI

InChI=1S/C10H6N2O5.Na.H2O/c13-10-7-4-2-1-3-6(7)8(11(14)15)5-9(10)12(16)17;;/h1-5,13H;;1H2/q;+1;/p-1