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4-ethyl-3,3-dimethyl-2-phosphono-4-pyridin-3-yl-hexanoate

4-ethyl-3,3-dimethyl-2-phosphono-4-pyridin-3-yl-hexanoate

Systemtic Name:4-ethyl-3,3-dimethyl-2-phosphono-4-pyridin-3-yl-hexanoate
Openeye Name:4-ethyl-3,3-dimethyl-2-phosphono-4-(3-pyridyl)hexanoate
CAS Name:4-ethyl-3,3-dimethyl-2-phosphono-4-(3-pyridinyl)hexanoate
IUPAC Name:4-ethyl-3,3-dimethyl-2-phosphono-4-pyridin-3-ylhexanoate
Traditional Name:4-ethyl-3,3-dimethyl-2-phosphono-4-(3-pyridyl)hexanoate
Formula: C15H23NO5P-
MolecularWeight: 328.320581
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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(C1=CN=CC=C1)C(C)(C)C(C(=O)[O-])P(=O)(O)O


Isomeric SMILES

CCC(CC)(C1=CN=CC=C1)C(C)(C)C(C(=O)[O-])P(=O)(O)O


InChI

InChI=1S/C15H24NO5P/c1-5-15(6-2,11-8-7-9-16-10-11)14(3,4)12(13(17)18)22(19,20)21/h7-10,12H,5-6H2,1-4H3,(H,17,18)(H2,19,20,21)/p-1


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