3-phenylsulfanylpentan-3-ylphosphonic acid

Systemtic Name: 3-phenylsulfanylpentan-3-ylphosphonic acid Openeye Name: (1-ethyl-1-phenylsulfanyl-propyl)phosphonic acid CAS Name: 3-(phenylthio)pentan-3-ylphosphonic acid IUPAC Name: 3-phenylsulfanylpentan-3-ylphosphonic acid Traditional Name: [1-ethyl-1-(phenylthio)propyl]phosphonic acid Formula: C11H17O3PS MolecularWeight: 260.289641

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(P(=O)(O)O)SC1=CC=CC=C1

Isomeric SMILES

CCC(CC)(P(=O)(O)O)SC1=CC=CC=C1

InChI

InChI=1S/C11H17O3PS/c1-3-11(4-2,15(12,13)14)16-10-8-6-5-7-9-10/h5-9H,3-4H2,1-2H3,(H2,12,13,14)