disodium 2-[[4-(oxidanylamino)phenyl]carbonylamino]pentanedioate

Systemtic Name: disodium 2-[[4-(oxidanylamino)phenyl]carbonylamino]pentanedioate Openeye Name: disodium 2-[[4-(hydroxyamino)benzoyl]amino]pentanedioate CAS Name: disodium 2-[[[4-(hydroxyamino)phenyl]-oxomethyl]amino]pentanedioate IUPAC Name: disodium 2-[[4-(hydroxyamino)benzoyl]amino]pentanedioate Traditional Name: disodium 2-[[4-(hydroxyamino)benzoyl]amino]glutarate Formula: C12H12N2Na2O6 MolecularWeight: 326.21302

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)NC(CCC(=O)[O-])C(=O)[O-])NO.[Na+].[Na+]

Isomeric SMILES

C1=CC(=CC=C1C(=O)NC(CCC(=O)[O-])C(=O)[O-])NO.[Na+].[Na+]

InChI

InChI=1S/C12H14N2O6.2Na/c15-10(16)6-5-9(12(18)19)13-11(17)7-1-3-8(14-20)4-2-7;;/h1-4,9,14,20H,5-6H2,(H,13,17)(H,15,16)(H,18,19);;/q;2*+1/p-2