4-bromanyl-2-[(E)-4-phosphonatobut-3-enyl]sulfanyl-phenol

Systemtic Name: 4-bromanyl-2-[(E)-4-phosphonatobut-3-enyl]sulfanyl-phenol Openeye Name: 4-bromo-2-[(E)-4-phosphonatobut-3-enyl]sulfanyl-phenol CAS Name: 4-bromo-2-[[(E)-4-phosphonatobut-3-enyl]thio]phenol IUPAC Name: 4-bromo-2-[(E)-4-phosphonatobut-3-enyl]sulfanylphenol Traditional Name: 4-bromo-2-[[(E)-4-phosphonatobut-3-enyl]thio]phenol Formula: C10H10BrO4PS-2 MolecularWeight: 337.126761

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Br)SCCC=CP(=O)([O-])[O-])O

Isomeric SMILES

C1=CC(=C(C=C1Br)SCC/C=C/P(=O)([O-])[O-])O

InChI

InChI=1S/C10H12BrO4PS/c11-8-3-4-9(12)10(7-8)17-6-2-1-5-16(13,14)15/h1,3-5,7,12H,2,6H2,(H2,13,14,15)/p-2/b5-1+