3-[3-(bromomethyl)-5-phenyl-phenyl]pentan-3-ylphosphonic acid

Systemtic Name: 3-[3-(bromomethyl)-5-phenyl-phenyl]pentan-3-ylphosphonic acid Openeye Name: [1-[3-(bromomethyl)-5-phenyl-phenyl]-1-ethyl-propyl]phosphonic acid CAS Name: 3-[3-(bromomethyl)-5-phenylphenyl]pentan-3-ylphosphonic acid IUPAC Name: 3-[3-(bromomethyl)-5-phenylphenyl]pentan-3-ylphosphonic acid Traditional Name: [1-[3-(bromomethyl)-5-phenyl-phenyl]-1-ethyl-propyl]phosphonic acid Formula: C18H22BrO3P MolecularWeight: 397.243241

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(C1=CC(=CC(=C1)CBr)C2=CC=CC=C2)P(=O)(O)O

Isomeric SMILES

CCC(CC)(C1=CC(=CC(=C1)CBr)C2=CC=CC=C2)P(=O)(O)O

InChI

InChI=1S/C18H22BrO3P/c1-3-18(4-2,23(20,21)22)17-11-14(13-19)10-16(12-17)15-8-6-5-7-9-15/h5-12H,3-4,13H2,1-2H3,(H2,20,21,22)