sodium 1,3,4,6-tetrakis(ethoxycarbonyl)-5-oxidanylidene-6,6a-dihydro-1H-pentalen-2-olate

Systemtic Name: sodium 1,3,4,6-tetrakis(ethoxycarbonyl)-5-oxidanylidene-6,6a-dihydro-1H-pentalen-2-olate Openeye Name: sodium 1,3,4,6-tetrakis(ethoxycarbonyl)-5-oxo-6,6a-dihydro-1H-pentalen-2-olate CAS Name: sodium 1,3,4,6-tetrakis(ethoxycarbonyl)-5-oxo-6,6a-dihydro-1H-pentalen-2-olate IUPAC Name: sodium 1,3,4,6-tetrakis(ethoxycarbonyl)-5-oxo-6,6a-dihydro-1H-pentalen-2-olate Traditional Name: sodium 1,3,4,6-tetracarbethoxy-5-keto-6,6a-dihydro-1H-pentalen-2-olate Formula: C20H23NaO10 MolecularWeight: 446.38039

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C2C(C(=O)C(=C2C(=C1[O-])C(=O)OCC)C(=O)OCC)C(=O)OCC.[Na+]

Isomeric SMILES

CCOC(=O)C1C2C(C(=O)C(=C2C(=C1[O-])C(=O)OCC)C(=O)OCC)C(=O)OCC.[Na+]

InChI

InChI=1S/C20H24O10.Na/c1-5-27-17(23)11-9-10(13(15(11)21)19(25)29-7-3)14(20(26)30-8-4)16(22)12(9)18(24)28-6-2;/h9,11-12,21H,5-8H2,1-4H3;/q;+1/p-1