4-(3,4-dichlorophenyl)-2-diethoxyphosphinothioylsulfanyl-4-oxidanylidene-butanoic acid

Systemtic Name: 4-(3,4-dichlorophenyl)-2-diethoxyphosphinothioylsulfanyl-4-oxidanylidene-butanoic acid Openeye Name: 4-(3,4-dichlorophenyl)-2-diethoxyphosphinothioylsulfanyl-4-oxo-butanoic acid CAS Name: 4-(3,4-dichlorophenyl)-2-(diethoxyphosphinothioylthio)-4-oxobutanoic acid IUPAC Name: 4-(3,4-dichlorophenyl)-2-diethoxyphosphinothioylsulfanyl-4-oxobutanoic acid Traditional Name: 4-(3,4-dichlorophenyl)-2-(diethoxythiophosphorylthio)-4-keto-butyric acid Formula: C14H17Cl2O5PS2 MolecularWeight: 431.291541

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOP(=S)(OCC)SC(CC(=O)C1=CC(=C(C=C1)Cl)Cl)C(=O)O

Isomeric SMILES

CCOP(=S)(OCC)SC(CC(=O)C1=CC(=C(C=C1)Cl)Cl)C(=O)O

InChI

InChI=1S/C14H17Cl2O5PS2/c1-3-20-22(23,21-4-2)24-13(14(18)19)8-12(17)9-5-6-10(15)11(16)7-9/h5-7,13H,3-4,8H2,1-2H3,(H,18,19)