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

Systemtic Name: methanol; (2E,5E)-4-[(E)-3-oxidanidyl-3-oxidanylidene-prop-1-enyl]-4-oxidanyl-hepta-2,5-dienedioate Openeye Name: (2E,5E)-4-hydroxy-4-[(E)-3-oxido-3-oxo-prop-1-enyl]hepta-2,5-dienedioate; methanol CAS Name: (2E,5E)-4-hydroxy-4-[(E)-3-oxido-3-oxoprop-1-enyl]hepta-2,5-dienedioate; methanol IUPAC Name: (2E,5E)-4-hydroxy-4-[(E)-3-oxido-3-oxoprop-1-enyl]hepta-2,5-dienedioate; methanol Traditional Name: (2E,5E)-4-hydroxy-4-[(E)-3-keto-3-oxido-prop-1-enyl]hepta-2,5-dienedioate; methanol Formula: C12H15O9-3 MolecularWeight: 303.2421

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Descriptors Computed from Structure

Canonical SMILES:

CO.CO.C(=CC(C=CC(=O)[O-])(C=CC(=O)[O-])O)C(=O)[O-]

Isomeric SMILES

CO.CO.C(=C/C(O)(/C=C/C(=O)[O-])/C=C/C(=O)[O-])\C(=O)[O-]

InChI

InChI=1S/C10H10O7.2CH4O/c11-7(12)1-4-10(17,5-2-8(13)14)6-3-9(15)16;2*1-2/h1-6,17H,(H,11,12)(H,13,14)(H,15,16);2*2H,1H3/p-3/b4-1+,5-2+,6-3+;;