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

Systemtic Name: methanal; (2E,5E)-4-[(E)-3-oxidanidyl-3-oxidanylidene-prop-1-enyl]-4-(3-oxidanylidenepropyl)hepta-2,5-dienedioate Openeye Name: formaldehyde; (2E,5E)-4-[(E)-3-oxido-3-oxo-prop-1-enyl]-4-(3-oxopropyl)hepta-2,5-dienedioate CAS Name: formaldehyde; (2E,5E)-4-[(E)-3-oxido-3-oxoprop-1-enyl]-4-(3-oxopropyl)hepta-2,5-dienedioate IUPAC Name: formaldehyde; (2E,5E)-4-[(E)-3-oxido-3-oxoprop-1-enyl]-4-(3-oxopropyl)hepta-2,5-dienedioate Traditional Name: formaldehyde; (2E,5E)-4-[(E)-3-keto-3-oxido-prop-1-enyl]-4-(3-ketopropyl)hepta-2,5-dienedioate Formula: C15H15O9-3 MolecularWeight: 339.2742

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H14O7.2CH2O/c14-9-1-5-13(6-2-10(15)16,7-3-11(17)18)8-4-12(19)20;2*1-2/h2-4,6-9H,1,5H2,(H,15,16)(H,17,18)(H,19,20);2*1H2/p-3/b6-2+,7-3+,8-4+;;