2-methyldodec-2-en-4-yl phosphono hydrogen phosphate

Systemtic Name: 2-methyldodec-2-en-4-yl phosphono hydrogen phosphate Openeye Name: 1-(2-methylprop-1-enyl)nonyl phosphono hydrogen phosphate CAS Name: 2-methyldodec-2-en-4-yl phosphono hydrogen phosphate IUPAC Name: 2-methyldodec-2-en-4-yl phosphono hydrogen phosphate Traditional Name: (3-methyl-1-octyl-but-2-enyl) phosphono hydrogen phosphate Formula: C13H28O7P2 MolecularWeight: 358.304742

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(C=C(C)C)OP(=O)(O)OP(=O)(O)O

Isomeric SMILES

CCCCCCCCC(C=C(C)C)OP(=O)(O)OP(=O)(O)O

InChI

InChI=1S/C13H28O7P2/c1-4-5-6-7-8-9-10-13(11-12(2)3)19-22(17,18)20-21(14,15)16/h11,13H,4-10H2,1-3H3,(H,17,18)(H2,14,15,16)