disodium 2-azanyl-5-oxidanylidene-5-(pyridin-3-ylcarbonylamino)pentanoate

Systemtic Name: disodium 2-azanyl-5-oxidanylidene-5-(pyridin-3-ylcarbonylamino)pentanoate Openeye Name: disodium 2-amino-5-oxo-5-(pyridine-3-carbonylamino)pentanoate CAS Name: disodium 2-amino-5-oxo-5-[[oxo(3-pyridinyl)methyl]amino]pentanoate IUPAC Name: disodium 2-amino-5-oxo-5-(pyridine-3-carbonylamino)pentanoate Traditional Name: disodium 2-amino-5-keto-5-nicotinamido-valerate Formula: C11H12N3Na2O4+ MolecularWeight: 296.21022

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)C(=O)NC(=O)CCC(C(=O)[O-])N.[Na+].[Na+]

Isomeric SMILES

C1=CC(=CN=C1)C(=O)NC(=O)CCC(C(=O)[O-])N.[Na+].[Na+]

InChI

InChI=1S/C11H13N3O4.2Na/c12-8(11(17)18)3-4-9(15)14-10(16)7-2-1-5-13-6-7;;/h1-2,5-6,8H,3-4,12H2,(H,17,18)(H,14,15,16);;/q;2*+1/p-1