2-[1-[oxidanyl(1-pyridin-3-ylpropyl)phosphoryl]heptyl]pentanedioic acid

Systemtic Name: 2-[1-[oxidanyl(1-pyridin-3-ylpropyl)phosphoryl]heptyl]pentanedioic acid Openeye Name: 2-[1-[hydroxy-[1-(3-pyridyl)propyl]phosphoryl]heptyl]pentanedioic acid CAS Name: 2-[1-[hydroxy-[1-(3-pyridinyl)propyl]phosphoryl]heptyl]pentanedioic acid IUPAC Name: 2-[1-[hydroxy(1-pyridin-3-ylpropyl)phosphoryl]heptyl]pentanedioic acid Traditional Name: 2-[1-[hydroxy-[1-(3-pyridyl)propyl]phosphoryl]heptyl]glutaric acid Formula: C20H32NO6P MolecularWeight: 413.444941

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H32NO6P/c1-3-5-6-7-10-18(16(20(24)25)11-12-19(22)23)28(26,27)17(4-2)15-9-8-13-21-14-15/h8-9,13-14,16-18H,3-7,10-12H2,1-2H3,(H,22,23)(H,24,25)(H,26,27)