(E)-but-2-enedioate; phosphono dihydrogen phosphate; phosphoric acid

Systemtic Name: (E)-but-2-enedioate; phosphono dihydrogen phosphate; phosphoric acid Openeye Name: (E)-but-2-enedioate; phosphono dihydrogen phosphate; phosphoric acid CAS Name: (E)-2-butenedioate; phosphono dihydrogen phosphate; phosphoric acid IUPAC Name: (E)-but-2-enedioate; phosphono dihydrogen phosphate; phosphoric acid Traditional Name: phosphono dihydrogen phosphate; phosphoric acid; fumarate Formula: C4H9O15P3-2 MolecularWeight: 390.026543

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C4H4O4.H4O7P2.H3O4P/c5-3(6)1-2-4(7)8;1-8(2,3)7-9(4,5)6;1-5(2,3)4/h1-2H,(H,5,6)(H,7,8);(H2,1,2,3)(H2,4,5,6);(H3,1,2,3,4)/p-2/b2-1+;;