3-[(4-hydroxyphenyl)methyl]pentan-3-ylphosphonic acid

Systemtic Name: 3-[(4-hydroxyphenyl)methyl]pentan-3-ylphosphonic acid Openeye Name: [1-ethyl-1-[(4-hydroxyphenyl)methyl]propyl]phosphonic acid CAS Name: 3-[(4-hydroxyphenyl)methyl]pentan-3-ylphosphonic acid IUPAC Name: 3-[(4-hydroxyphenyl)methyl]pentan-3-ylphosphonic acid Traditional Name: [1-ethyl-1-(4-hydroxybenzyl)propyl]phosphonic acid Formula: C12H19O4P MolecularWeight: 258.250621

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H19O4P/c1-3-12(4-2,17(14,15)16)9-10-5-7-11(13)8-6-10/h5-8,13H,3-4,9H2,1-2H3,(H2,14,15,16)