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3-[ethoxy(3-phosphonopentan-3-yl)phosphoryl]pentan-3-ylphosphonic acid

3-[ethoxy(3-phosphonopentan-3-yl)phosphoryl]pentan-3-ylphosphonic acid

Systemtic Name:3-[ethoxy(3-phosphonopentan-3-yl)phosphoryl]pentan-3-ylphosphonic acid
Openeye Name:[1-[ethoxy-(1-ethyl-1-phosphono-propyl)phosphoryl]-1-ethyl-propyl]phosphonic acid
CAS Name:3-[ethoxy(3-phosphonopentan-3-yl)phosphoryl]pentan-3-ylphosphonic acid
IUPAC Name:3-[ethoxy(3-phosphonopentan-3-yl)phosphoryl]pentan-3-ylphosphonic acid
Traditional Name:[1-[ethoxy-(1-ethyl-1-phosphono-propyl)phosphoryl]-1-ethyl-propyl]phosphonic acid
Formula: C12H29O8P3
MolecularWeight: 394.275143
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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(P(=O)(C(CC)(CC)P(=O)(O)O)OCC)P(=O)(O)O


Isomeric SMILES

CCC(CC)(P(=O)(C(CC)(CC)P(=O)(O)O)OCC)P(=O)(O)O


InChI

InChI=1S/C12H29O8P3/c1-6-11(7-2,22(14,15)16)21(13,20-10-5)12(8-3,9-4)23(17,18)19/h6-10H2,1-5H3,(H2,14,15,16)(H2,17,18,19)


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