calcium 4-azanyl-2-oxidanyl-benzoate

Systemtic Name: calcium 4-azanyl-2-oxidanyl-benzoate Openeye Name: calcium 4-amino-2-hydroxy-benzoate CAS Name: calcium 4-amino-2-hydroxybenzoate IUPAC Name: calcium 4-amino-2-hydroxybenzoate Traditional Name: calcium 4-amino-2-hydroxy-benzoate Formula: C14H12CaN2O6 MolecularWeight: 344.33288

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1N)O)C(=O)[O-].C1=CC(=C(C=C1N)O)C(=O)[O-].[Ca+2]

Isomeric SMILES

C1=CC(=C(C=C1N)O)C(=O)[O-].C1=CC(=C(C=C1N)O)C(=O)[O-].[Ca+2]

InChI

InChI=1S/2C7H7NO3.Ca/c2*8-4-1-2-5(7(10)11)6(9)3-4;/h2*1-3,9H,8H2,(H,10,11);/q;;+2/p-2