3,4-bis(azanylidene)-2,5-bis(ethoxycarbonyl)hexanedioic acid; sodium

Systemtic Name: 3,4-bis(azanylidene)-2,5-bis(ethoxycarbonyl)hexanedioic acid; sodium Openeye Name: 2,5-bis(ethoxycarbonyl)-3,4-diimino-hexanedioic acid; sodium CAS Name: 2,5-bis(ethoxycarbonyl)-3,4-diiminohexanedioic acid; sodium IUPAC Name: 2,5-bis(ethoxycarbonyl)-3,4-diiminohexanedioic acid; sodium Traditional Name: 2,5-dicarbethoxy-3,4-diimino-adipic acid; sodium Formula: C12H16N2NaO8 MolecularWeight: 339.25381

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(=N)C(=N)C(C(=O)O)C(=O)OCC)C(=O)O.[Na]

Isomeric SMILES

CCOC(=O)C(C(=N)C(=N)C(C(=O)O)C(=O)OCC)C(=O)O.[Na]

InChI

InChI=1S/C12H16N2O8.Na/c1-3-21-11(19)5(9(15)16)7(13)8(14)6(10(17)18)12(20)22-4-2;/h5-6,13-14H,3-4H2,1-2H3,(H,15,16)(H,17,18);