3-[diethoxyphosphorylmethyl(methyl)sulfonio]-4-oxidanylidene-1H-quinolin-2-olate

Systemtic Name: 3-[diethoxyphosphorylmethyl(methyl)sulfonio]-4-oxidanylidene-1H-quinolin-2-olate Openeye Name: 3-[diethoxyphosphorylmethyl(methyl)sulfonio]-4-oxo-1H-quinolin-2-olate CAS Name: 3-[diethoxyphosphorylmethyl(methyl)sulfonio]-4-oxo-1H-quinolin-2-olate IUPAC Name: 3-[diethoxyphosphorylmethyl(methyl)sulfonio]-4-oxo-1H-quinolin-2-olate Traditional Name: 3-[diethoxyphosphorylmethyl(methyl)sulfonio]-4-keto-1H-quinolin-2-olate Formula: C15H20NO5PS MolecularWeight: 357.361761

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C[S+](C)C1=C(NC2=CC=CC=C2C1=O)[O-])OCC

Isomeric SMILES

CCOP(=O)(C[S+](C)C1=C(NC2=CC=CC=C2C1=O)[O-])OCC

InChI

InChI=1S/C15H20NO5PS/c1-4-20-22(19,21-5-2)10-23(3)14-13(17)11-8-6-7-9-12(11)16-15(14)18/h6-9H,4-5,10H2,1-3H3,(H-,16,17,18)