5-chloranyl-1-isothiocyanato-pentan-1-one

Systemtic Name: 5-chloranyl-1-isothiocyanato-pentan-1-one Openeye Name: 5-chloropentanoyl isothiocyanate CAS Name: 5-chloro-1-isothiocyanato-1-pentanone IUPAC Name: 5-chloropentanoyl isothiocyanate Traditional Name: 5-chloro-1-isothiocyanato-pentan-1-one Formula: C6H8ClNOS MolecularWeight: 177.65182

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Descriptors Computed from Structure

Canonical SMILES:

C(CCCl)CC(=O)N=C=S

Isomeric SMILES

C(CCCl)CC(=O)N=C=S

InChI

InChI=1S/C6H8ClNOS/c7-4-2-1-3-6(9)8-5-10/h1-4H2