(4-cyano-4-ethyl-hexan-2-yl)phosphonic acid

Systemtic Name: (4-cyano-4-ethyl-hexan-2-yl)phosphonic acid Openeye Name: (3-cyano-3-ethyl-1-methyl-pentyl)phosphonic acid CAS Name: (4-cyano-4-ethylhexan-2-yl)phosphonic acid IUPAC Name: (4-cyano-4-ethylhexan-2-yl)phosphonic acid Traditional Name: (3-cyano-3-ethyl-1-methyl-pentyl)phosphonic acid Formula: C9H18NO3P MolecularWeight: 219.217881

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(CC(C)P(=O)(O)O)C#N

Isomeric SMILES

CCC(CC)(CC(C)P(=O)(O)O)C#N

InChI

InChI=1S/C9H18NO3P/c1-4-9(5-2,7-10)6-8(3)14(11,12)13/h8H,4-6H2,1-3H3,(H2,11,12,13)