(2-carboxy-1-oxidanyl-pentyl)-oxidanylidene-(phenylsulfanylmethyl)phosphanium

Systemtic Name: (2-carboxy-1-oxidanyl-pentyl)-oxidanylidene-(phenylsulfanylmethyl)phosphanium Openeye Name: (2-carboxy-1-hydroxy-pentyl)-oxo-(phenylsulfanylmethyl)phosphonium CAS Name: (2-carboxy-1-hydroxypentyl)-oxo-[(phenylthio)methyl]phosphonium IUPAC Name: (2-carboxy-1-hydroxypentyl)-oxo-(phenylsulfanylmethyl)phosphanium Traditional Name: (2-carboxy-1-hydroxy-pentyl)-keto-[(phenylthio)methyl]phosphonium Formula: C13H18O4PS+ MolecularWeight: 301.318381

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(O)[P+](=O)CSC1=CC=CC=C1)C(=O)O

Isomeric SMILES

CCCC(C(O)[P+](=O)CSC1=CC=CC=C1)C(=O)O

InChI

InChI=1S/C13H17O4PS/c1-2-6-11(12(14)15)13(16)18(17)9-19-10-7-4-3-5-8-10/h3-5,7-8,11,13,16H,2,6,9H2,1H3/p+1