3-[oxidanyl(pyridin-4-yl)phosphoryl]-2-phenyl-octanoic acid

Systemtic Name: 3-[oxidanyl(pyridin-4-yl)phosphoryl]-2-phenyl-octanoic acid Openeye Name: 3-[hydroxy(4-pyridyl)phosphoryl]-2-phenyl-octanoic acid CAS Name: 3-[hydroxy(pyridin-4-yl)phosphoryl]-2-phenyloctanoic acid IUPAC Name: 3-[hydroxy(pyridin-4-yl)phosphoryl]-2-phenyloctanoic acid Traditional Name: 3-[hydroxy(4-pyridyl)phosphoryl]-2-phenyl-caprylic acid Formula: C19H24NO4P MolecularWeight: 361.371921

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C(C1=CC=CC=C1)C(=O)O)P(=O)(C2=CC=NC=C2)O

Isomeric SMILES

CCCCCC(C(C1=CC=CC=C1)C(=O)O)P(=O)(C2=CC=NC=C2)O

InChI

InChI=1S/C19H24NO4P/c1-2-3-5-10-17(25(23,24)16-11-13-20-14-12-16)18(19(21)22)15-8-6-4-7-9-15/h4,6-9,11-14,17-18H,2-3,5,10H2,1H3,(H,21,22)(H,23,24)