2-[4-(2-methylpropyl)phenyl]propanoylphosphonic acid

Systemtic Name: 2-[4-(2-methylpropyl)phenyl]propanoylphosphonic acid Openeye Name: 2-(4-isobutylphenyl)propanoylphosphonic acid CAS Name: [2-[4-(2-methylpropyl)phenyl]-1-oxopropyl]phosphonic acid IUPAC Name: 2-[4-(2-methylpropyl)phenyl]propanoylphosphonic acid Traditional Name: 2-(4-isobutylphenyl)propanoylphosphonic acid Formula: C13H19O4P MolecularWeight: 270.261321

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H19O4P/c1-9(2)8-11-4-6-12(7-5-11)10(3)13(14)18(15,16)17/h4-7,9-10H,8H2,1-3H3,(H2,15,16,17)