2,2,2-tris[butoxy(oxidanyl)phosphoryl]ethanoate

Systemtic Name: 2,2,2-tris[butoxy(oxidanyl)phosphoryl]ethanoate Openeye Name: 2,2,2-tris[butoxy(hydroxy)phosphoryl]acetate CAS Name: 2,2,2-tris[butoxy(hydroxy)phosphoryl]acetate IUPAC Name: 2,2,2-tris[butoxy(hydroxy)phosphoryl]acetate Traditional Name: 2,2,2-tris[butoxy(hydroxy)phosphoryl]acetate Formula: C14H30O11P3- MolecularWeight: 467.302683

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOP(=O)(C(C(=O)[O-])(P(=O)(O)OCCCC)P(=O)(O)OCCCC)O

Isomeric SMILES

CCCCOP(=O)(C(C(=O)[O-])(P(=O)(O)OCCCC)P(=O)(O)OCCCC)O

InChI

InChI=1S/C14H31O11P3/c1-4-7-10-23-26(17,18)14(13(15)16,27(19,20)24-11-8-5-2)28(21,22)25-12-9-6-3/h4-12H2,1-3H3,(H,15,16)(H,17,18)(H,19,20)(H,21,22)/p-1