[1-[3-(phenylcarbonylsulfanyl)propanoyl]piperidin-2-yl]phosphonic acid

Systemtic Name: [1-[3-(phenylcarbonylsulfanyl)propanoyl]piperidin-2-yl]phosphonic acid Openeye Name: [1-(3-benzoylsulfanylpropanoyl)-2-piperidyl]phosphonic acid CAS Name: [1-[3-(benzoylthio)-1-oxopropyl]-2-piperidinyl]phosphonic acid IUPAC Name: [1-(3-benzoylsulfanylpropanoyl)piperidin-2-yl]phosphonic acid Traditional Name: [1-[3-(benzoylthio)propanoyl]-2-piperidyl]phosphonic acid Formula: C15H20NO5PS MolecularWeight: 357.361761

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)P(=O)(O)O)C(=O)CCSC(=O)C2=CC=CC=C2

Isomeric SMILES

C1CCN(C(C1)P(=O)(O)O)C(=O)CCSC(=O)C2=CC=CC=C2

InChI

InChI=1S/C15H20NO5PS/c17-13(16-10-5-4-8-14(16)22(19,20)21)9-11-23-15(18)12-6-2-1-3-7-12/h1-3,6-7,14H,4-5,8-11H2,(H2,19,20,21)