5-(diphenylphosphorylmethylsulfanyl)-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-(diphenylphosphorylmethylsulfanyl)-5-oxidanylidene-pentanoic acid Openeye Name: 5-(diphenylphosphorylmethylsulfanyl)-5-oxo-pentanoic acid CAS Name: 5-(diphenylphosphorylmethylthio)-5-oxopentanoic acid IUPAC Name: 5-(diphenylphosphorylmethylsulfanyl)-5-oxopentanoic acid Traditional Name: 5-(diphenylphosphorylmethylthio)-5-keto-valeric acid Formula: C18H19O4PS MolecularWeight: 362.379821

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)P(=O)(CSC(=O)CCCC(=O)O)C2=CC=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)P(=O)(CSC(=O)CCCC(=O)O)C2=CC=CC=C2

InChI

InChI=1S/C18H19O4PS/c19-17(20)12-7-13-18(21)24-14-23(22,15-8-3-1-4-9-15)16-10-5-2-6-11-16/h1-6,8-11H,7,12-14H2,(H,19,20)