S-ethyl (E)-4-dimethoxyphosphoryl-3-methyl-but-2-enethioate

Systemtic Name: S-ethyl (E)-4-dimethoxyphosphoryl-3-methyl-but-2-enethioate Openeye Name: S-ethyl (E)-4-dimethoxyphosphoryl-3-methyl-but-2-enethioate CAS Name: (E)-4-dimethoxyphosphoryl-3-methyl-2-butenethioic acid S-ethyl ester IUPAC Name: S-ethyl (E)-4-dimethoxyphosphoryl-3-methylbut-2-enethioate Traditional Name: (E)-4-dimethoxyphosphoryl-3-methyl-but-2-enethioic acid S-ethyl ester Formula: C9H17O4PS MolecularWeight: 252.267641

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Descriptors Computed from Structure

Canonical SMILES:

CCSC(=O)C=C(C)CP(=O)(OC)OC

Isomeric SMILES

CCSC(=O)/C=C(\C)/CP(=O)(OC)OC

InChI

InChI=1S/C9H17O4PS/c1-5-15-9(10)6-8(2)7-14(11,12-3)13-4/h6H,5,7H2,1-4H3/b8-6+