4-diethoxyphosphoryl-4-oxidanyl-4-thiophen-2-yl-butan-2-one

Systemtic Name: 4-diethoxyphosphoryl-4-oxidanyl-4-thiophen-2-yl-butan-2-one Openeye Name: 4-diethoxyphosphoryl-4-hydroxy-4-(2-thienyl)butan-2-one CAS Name: 4-diethoxyphosphoryl-4-hydroxy-4-thiophen-2-yl-2-butanone IUPAC Name: 4-diethoxyphosphoryl-4-hydroxy-4-thiophen-2-ylbutan-2-one Traditional Name: 4-diethoxyphosphoryl-4-hydroxy-4-(2-thienyl)butan-2-one Formula: C12H19O5PS MolecularWeight: 306.315021

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C(CC(=O)C)(C1=CC=CS1)O)OCC

Isomeric SMILES

CCOP(=O)(C(CC(=O)C)(C1=CC=CS1)O)OCC

InChI

InChI=1S/C12H19O5PS/c1-4-16-18(15,17-5-2)12(14,9-10(3)13)11-7-6-8-19-11/h6-8,14H,4-5,9H2,1-3H3