sodium 2-[(2-cyano-3-morpholin-4-yl-phenyl)amino]-2-oxidanylidene-ethanoate

Systemtic Name: sodium 2-[(2-cyano-3-morpholin-4-yl-phenyl)amino]-2-oxidanylidene-ethanoate Openeye Name: sodium 2-(2-cyano-3-morpholino-anilino)-2-oxo-acetate CAS Name: sodium 2-[2-cyano-3-(4-morpholinyl)anilino]-2-oxoacetate IUPAC Name: sodium 2-(2-cyano-3-morpholin-4-ylanilino)-2-oxoacetate Traditional Name: sodium 2-(2-cyano-3-morpholino-anilino)-2-keto-acetate Formula: C13H12N3NaO4 MolecularWeight: 297.24185

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C(=CC=C2)NC(=O)C(=O)[O-])C#N.[Na+]

Isomeric SMILES

C1COCCN1C2=C(C(=CC=C2)NC(=O)C(=O)[O-])C#N.[Na+]

InChI

InChI=1S/C13H13N3O4.Na/c14-8-9-10(15-12(17)13(18)19)2-1-3-11(9)16-4-6-20-7-5-16;/h1-3H,4-7H2,(H,15,17)(H,18,19);/q;+1/p-1