sodium; cyanoboron(1-); 3-methanoylbenzoic acid

Systemtic Name: sodium; cyanoboron(1-); 3-methanoylbenzoic acid Openeye Name: sodium; cyanoboron(1-); 3-formylbenzoic acid CAS Name: sodium; cyanoboron(1-); 3-formylbenzoic acid IUPAC Name: sodium; cyanoboron(1-); 3-formylbenzoic acid Traditional Name: sodium; cyanoboron(1-); isophthalaldehydic acid Formula: C9H6BNNaO3 MolecularWeight: 209.94961

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H6O3.CBN.Na/c9-5-6-2-1-3-7(4-6)8(10)11;2-1-3;/h1-5H,(H,10,11);;/q;-1;+1