3-methyl-1-oxidanyl-1-(2-phenylthiophen-3-yl)-3-phosphonato-butan-2-one

Systemtic Name: 3-methyl-1-oxidanyl-1-(2-phenylthiophen-3-yl)-3-phosphonato-butan-2-one Openeye Name: 1-hydroxy-3-methyl-1-(2-phenyl-3-thienyl)-3-phosphonato-butan-2-one CAS Name: 1-hydroxy-3-methyl-1-(2-phenyl-3-thiophenyl)-3-phosphonato-2-butanone IUPAC Name: 1-hydroxy-3-methyl-1-(2-phenylthiophen-3-yl)-3-phosphonatobutan-2-one Traditional Name: 1-hydroxy-3-methyl-1-(2-phenyl-3-thienyl)-3-phosphonato-butan-2-one Formula: C15H15O5PS-2 MolecularWeight: 338.315361

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)C(C1=C(SC=C1)C2=CC=CC=C2)O)P(=O)([O-])[O-]

Isomeric SMILES

CC(C)(C(=O)C(C1=C(SC=C1)C2=CC=CC=C2)O)P(=O)([O-])[O-]

InChI

InChI=1S/C15H17O5PS/c1-15(2,21(18,19)20)14(17)12(16)11-8-9-22-13(11)10-6-4-3-5-7-10/h3-9,12,16H,1-2H3,(H2,18,19,20)/p-2