4-(1-chloranyl-2-methylsulfanyl-propyl)octanal

Systemtic Name: 4-(1-chloranyl-2-methylsulfanyl-propyl)octanal Openeye Name: 4-(1-chloro-2-methylsulfanyl-propyl)octanal CAS Name: 4-[1-chloro-2-(methylthio)propyl]octanal IUPAC Name: 4-(1-chloro-2-methylsulfanylpropyl)octanal Traditional Name: 4-[1-chloro-2-(methylthio)propyl]caprylaldehyde Formula: C12H23ClOS MolecularWeight: 250.82842

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CCC=O)C(C(C)SC)Cl

Isomeric SMILES

CCCCC(CCC=O)C(C(C)SC)Cl

InChI

InChI=1S/C12H23ClOS/c1-4-5-7-11(8-6-9-14)12(13)10(2)15-3/h9-12H,4-8H2,1-3H3