(E)-2,4,4-tris[ethoxy(oxidanyl)phosphoryl]-3-methyl-but-2-enoate

Systemtic Name: (E)-2,4,4-tris[ethoxy(oxidanyl)phosphoryl]-3-methyl-but-2-enoate Openeye Name: (E)-2,4,4-tris[ethoxy(hydroxy)phosphoryl]-3-methyl-but-2-enoate CAS Name: (E)-2,4,4-tris[ethoxy(hydroxy)phosphoryl]-3-methyl-2-butenoate IUPAC Name: (E)-2,4,4-tris[ethoxy(hydroxy)phosphoryl]-3-methylbut-2-enoate Traditional Name: (E)-2,4,4-tris[ethoxy(hydroxy)phosphoryl]-3-methyl-but-2-enoate Formula: C11H22O11P3- MolecularWeight: 423.207063

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C(C(=C(C(=O)[O-])P(=O)(O)OCC)C)P(=O)(O)OCC)O

Isomeric SMILES

CCOP(=O)(C(/C(=C(\C(=O)[O-])/P(=O)(O)OCC)/C)P(=O)(O)OCC)O

InChI

InChI=1S/C11H23O11P3/c1-5-20-23(14,15)9(10(12)13)8(4)11(24(16,17)21-6-2)25(18,19)22-7-3/h11H,5-7H2,1-4H3,(H,12,13)(H,14,15)(H,16,17)(H,18,19)/p-1/b9-8+