3-ethoxycarbonylhexan-3-ylphosphonic acid

Systemtic Name: 3-ethoxycarbonylhexan-3-ylphosphonic acid Openeye Name: (1-ethoxycarbonyl-1-ethyl-butyl)phosphonic acid CAS Name: 3-ethoxycarbonylhexan-3-ylphosphonic acid IUPAC Name: 3-ethoxycarbonylhexan-3-ylphosphonic acid Traditional Name: (1-carbethoxy-1-ethyl-butyl)phosphonic acid Formula: C9H19O5P MolecularWeight: 238.217921

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CC)(C(=O)OCC)P(=O)(O)O

Isomeric SMILES

CCCC(CC)(C(=O)OCC)P(=O)(O)O

InChI

InChI=1S/C9H19O5P/c1-4-7-9(5-2,15(11,12)13)8(10)14-6-3/h4-7H2,1-3H3,(H2,11,12,13)