(2-carboxy-2-ethoxy-4-methyl-pentyl)-oxidanylidene-(phenylsulfanylmethyl)phosphanium

Systemtic Name: (2-carboxy-2-ethoxy-4-methyl-pentyl)-oxidanylidene-(phenylsulfanylmethyl)phosphanium Openeye Name: (2-carboxy-2-ethoxy-4-methyl-pentyl)-oxo-(phenylsulfanylmethyl)phosphonium CAS Name: (2-carboxy-2-ethoxy-4-methylpentyl)-oxo-[(phenylthio)methyl]phosphonium IUPAC Name: (2-carboxy-2-ethoxy-4-methylpentyl)-oxo-(phenylsulfanylmethyl)phosphanium Traditional Name: (2-carboxy-2-ethoxy-4-methyl-pentyl)-keto-[(phenylthio)methyl]phosphonium Formula: C16H24O4PS+ MolecularWeight: 343.398121

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H23O4PS/c1-4-20-16(15(17)18,10-13(2)3)11-21(19)12-22-14-8-6-5-7-9-14/h5-9,13H,4,10-12H2,1-3H3/p+1