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[2-(3-decoxyphenyl)-1-oxidanyl-1-phosphono-ethyl]phosphonic acid

[2-(3-decoxyphenyl)-1-oxidanyl-1-phosphono-ethyl]phosphonic acid

Systemtic Name:[2-(3-decoxyphenyl)-1-oxidanyl-1-phosphono-ethyl]phosphonic acid
Openeye Name:[2-(3-decoxyphenyl)-1-hydroxy-1-phosphono-ethyl]phosphonic acid
CAS Name:[2-(3-decoxyphenyl)-1-hydroxy-1-phosphonoethyl]phosphonic acid
IUPAC Name:[2-(3-decoxyphenyl)-1-hydroxy-1-phosphonoethyl]phosphonic acid
Traditional Name:[2-(3-decoxyphenyl)-1-hydroxy-1-phosphono-ethyl]phosphonic acid
Formula: C18H32O8P2
MolecularWeight: 438.389402
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=CC=CC(=C1)CC(O)(P(=O)(O)O)P(=O)(O)O


Isomeric SMILES

CCCCCCCCCCOC1=CC=CC(=C1)CC(O)(P(=O)(O)O)P(=O)(O)O


InChI

InChI=1S/C18H32O8P2/c1-2-3-4-5-6-7-8-9-13-26-17-12-10-11-16(14-17)15-18(19,27(20,21)22)28(23,24)25/h10-12,14,19H,2-9,13,15H2,1H3,(H2,20,21,22)(H2,23,24,25)


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