(2,8-dimethyl-5-phosphono-nona-2,7-dien-5-yl)phosphonic acid

Systemtic Name: (2,8-dimethyl-5-phosphono-nona-2,7-dien-5-yl)phosphonic acid Openeye Name: [4-methyl-1-(3-methylbut-2-enyl)-1-phosphono-pent-3-enyl]phosphonic acid CAS Name: (2,8-dimethyl-5-phosphononona-2,7-dien-5-yl)phosphonic acid IUPAC Name: (2,8-dimethyl-5-phosphononona-2,7-dien-5-yl)phosphonic acid Traditional Name: [4-methyl-1-(3-methylbut-2-enyl)-1-phosphono-pent-3-enyl]phosphonic acid Formula: C11H22O6P2 MolecularWeight: 312.236302

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H22O6P2/c1-9(2)5-7-11(18(12,13)14,19(15,16)17)8-6-10(3)4/h5-6H,7-8H2,1-4H3,(H2,12,13,14)(H2,15,16,17)