prop-2-enoic acid; 2,3,4-tris(oxidanyl)butyl dihydrogen phosphate

Systemtic Name: prop-2-enoic acid; 2,3,4-tris(oxidanyl)butyl dihydrogen phosphate Openeye Name: acrylic acid; 2,3,4-trihydroxybutyl dihydrogen phosphate CAS Name: 2-propenoic acid; 2,3,4-trihydroxybutyl dihydrogen phosphate IUPAC Name: prop-2-enoic acid; 2,3,4-trihydroxybutyl dihydrogen phosphate Traditional Name: acrylic acid; 2,3,4-trihydroxybutyl dihydrogen phosphate Formula: C19H31O17P MolecularWeight: 562.413001

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Descriptors Computed from Structure

Canonical SMILES:

C=CC(=O)O.C=CC(=O)O.C=CC(=O)O.C=CC(=O)O.C=CC(=O)O.C(C(C(COP(=O)(O)O)O)O)O

Isomeric SMILES

C=CC(=O)O.C=CC(=O)O.C=CC(=O)O.C=CC(=O)O.C=CC(=O)O.C(C(C(COP(=O)(O)O)O)O)O

InChI

InChI=1S/C4H11O7P.5C3H4O2/c5-1-3(6)4(7)2-11-12(8,9)10;5*1-2-3(4)5/h3-7H,1-2H2,(H2,8,9,10);5*2H,1H2,(H,4,5)