(3-cyano-4-ethyl-hexan-3-yl)phosphonic acid

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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