(2-ethyl-2-pyridin-4-yl-butyl)phosphonic acid

Systemtic Name: (2-ethyl-2-pyridin-4-yl-butyl)phosphonic acid Openeye Name: [2-ethyl-2-(4-pyridyl)butyl]phosphonic acid CAS Name: (2-ethyl-2-pyridin-4-ylbutyl)phosphonic acid IUPAC Name: (2-ethyl-2-pyridin-4-ylbutyl)phosphonic acid Traditional Name: [2-ethyl-2-(4-pyridyl)butyl]phosphonic acid Formula: C11H18NO3P MolecularWeight: 243.239281

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(CP(=O)(O)O)C1=CC=NC=C1

Isomeric SMILES

CCC(CC)(CP(=O)(O)O)C1=CC=NC=C1

InChI

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