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2-[1-[oxidanyl(1-pyridin-3-ylethyl)phosphoryl]hexyl]pentanedioic acid

2-[1-[oxidanyl(1-pyridin-3-ylethyl)phosphoryl]hexyl]pentanedioic acid

Systemtic Name:2-[1-[oxidanyl(1-pyridin-3-ylethyl)phosphoryl]hexyl]pentanedioic acid
Openeye Name:2-[1-[hydroxy-[1-(3-pyridyl)ethyl]phosphoryl]hexyl]pentanedioic acid
CAS Name:2-[1-[hydroxy-[1-(3-pyridinyl)ethyl]phosphoryl]hexyl]pentanedioic acid
IUPAC Name:2-[1-[hydroxy(1-pyridin-3-ylethyl)phosphoryl]hexyl]pentanedioic acid
Traditional Name:2-[1-[hydroxy-[1-(3-pyridyl)ethyl]phosphoryl]hexyl]glutaric acid
Formula: C18H28NO6P
MolecularWeight: 385.391781
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C(CCC(=O)O)C(=O)O)P(=O)(C(C)C1=CN=CC=C1)O


Isomeric SMILES

CCCCCC(C(CCC(=O)O)C(=O)O)P(=O)(C(C)C1=CN=CC=C1)O


InChI

InChI=1S/C18H28NO6P/c1-3-4-5-8-16(15(18(22)23)9-10-17(20)21)26(24,25)13(2)14-7-6-11-19-12-14/h6-7,11-13,15-16H,3-5,8-10H2,1-2H3,(H,20,21)(H,22,23)(H,24,25)


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