(2E,5E)-4-ethyl-4-[(E)-3-oxidanidyl-3-oxidanylidene-prop-1-enyl]hepta-2,5-dienedioate

Systemtic Name: (2E,5E)-4-ethyl-4-[(E)-3-oxidanidyl-3-oxidanylidene-prop-1-enyl]hepta-2,5-dienedioate Openeye Name: (2E,5E)-4-ethyl-4-[(E)-3-oxido-3-oxo-prop-1-enyl]hepta-2,5-dienedioate CAS Name: (2E,5E)-4-ethyl-4-[(E)-3-oxido-3-oxoprop-1-enyl]hepta-2,5-dienedioate IUPAC Name: (2E,5E)-4-ethyl-4-[(E)-3-oxido-3-oxoprop-1-enyl]hepta-2,5-dienedioate Traditional Name: (2E,5E)-4-ethyl-4-[(E)-3-keto-3-oxido-prop-1-enyl]hepta-2,5-dienedioate Formula: C12H11O6-3 MolecularWeight: 251.21214

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C=CC(=O)[O-])(C=CC(=O)[O-])C=CC(=O)[O-]

Isomeric SMILES

CCC(/C=C/C(=O)[O-])(/C=C/C(=O)[O-])/C=C/C(=O)[O-]

InChI

InChI=1S/C12H14O6/c1-2-12(6-3-9(13)14,7-4-10(15)16)8-5-11(17)18/h3-8H,2H2,1H3,(H,13,14)(H,15,16)(H,17,18)/p-3/b6-3+,7-4+,8-5+