(4-ethoxycarbonyl-4-ethyl-2-methyl-hexyl)phosphonic acid

Systemtic Name: (4-ethoxycarbonyl-4-ethyl-2-methyl-hexyl)phosphonic acid Openeye Name: (4-ethoxycarbonyl-4-ethyl-2-methyl-hexyl)phosphonic acid CAS Name: (4-ethoxycarbonyl-4-ethyl-2-methylhexyl)phosphonic acid IUPAC Name: (4-ethoxycarbonyl-4-ethyl-2-methylhexyl)phosphonic acid Traditional Name: (4-carbethoxy-4-ethyl-2-methyl-hexyl)phosphonic acid Formula: C12H25O5P MolecularWeight: 280.297661

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(CC(C)CP(=O)(O)O)C(=O)OCC

Isomeric SMILES

CCC(CC)(CC(C)CP(=O)(O)O)C(=O)OCC

InChI

InChI=1S/C12H25O5P/c1-5-12(6-2,11(13)17-7-3)8-10(4)9-18(14,15)16/h10H,5-9H2,1-4H3,(H2,14,15,16)