[2-[4-(2-methylprop-1-enyl)phenyl]-1-phosphono-ethyl]phosphonic acid

Systemtic Name: [2-[4-(2-methylprop-1-enyl)phenyl]-1-phosphono-ethyl]phosphonic acid Openeye Name: [2-[4-(2-methylprop-1-enyl)phenyl]-1-phosphono-ethyl]phosphonic acid CAS Name: [2-[4-(2-methylprop-1-enyl)phenyl]-1-phosphonoethyl]phosphonic acid IUPAC Name: [2-[4-(2-methylprop-1-enyl)phenyl]-1-phosphonoethyl]phosphonic acid Traditional Name: [2-[4-(2-methylprop-1-enyl)phenyl]-1-phosphono-ethyl]phosphonic acid Formula: C12H18O6P2 MolecularWeight: 320.215242

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC1=CC=C(C=C1)CC(P(=O)(O)O)P(=O)(O)O)C

Isomeric SMILES

CC(=CC1=CC=C(C=C1)CC(P(=O)(O)O)P(=O)(O)O)C

InChI

InChI=1S/C12H18O6P2/c1-9(2)7-10-3-5-11(6-4-10)8-12(19(13,14)15)20(16,17)18/h3-7,12H,8H2,1-2H3,(H2,13,14,15)(H2,16,17,18)