3-pyridin-4-ylhexan-3-ylphosphonic acid

Systemtic Name: 3-pyridin-4-ylhexan-3-ylphosphonic acid Openeye Name: [1-ethyl-1-(4-pyridyl)butyl]phosphonic acid CAS Name: 3-pyridin-4-ylhexan-3-ylphosphonic acid IUPAC Name: 3-pyridin-4-ylhexan-3-ylphosphonic acid Traditional Name: [1-ethyl-1-(4-pyridyl)butyl]phosphonic acid Formula: C11H18NO3P MolecularWeight: 243.239281

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CC)(C1=CC=NC=C1)P(=O)(O)O

Isomeric SMILES

CCCC(CC)(C1=CC=NC=C1)P(=O)(O)O

InChI

InChI=1S/C11H18NO3P/c1-3-7-11(4-2,16(13,14)15)10-5-8-12-9-6-10/h5-6,8-9H,3-4,7H2,1-2H3,(H2,13,14,15)