(3-ethyl-3-pyridin-4-yl-pentyl)phosphonic acid

Systemtic Name: (3-ethyl-3-pyridin-4-yl-pentyl)phosphonic acid Openeye Name: [3-ethyl-3-(4-pyridyl)pentyl]phosphonic acid CAS Name: (3-ethyl-3-pyridin-4-ylpentyl)phosphonic acid IUPAC Name: (3-ethyl-3-pyridin-4-ylpentyl)phosphonic acid Traditional Name: [3-ethyl-3-(4-pyridyl)pentyl]phosphonic acid Formula: C12H20NO3P MolecularWeight: 257.265861

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H20NO3P/c1-3-12(4-2,7-10-17(14,15)16)11-5-8-13-9-6-11/h5-6,8-9H,3-4,7,10H2,1-2H3,(H2,14,15,16)