isothiocyanato(oxan-4-yl)methanone

Systemtic Name: isothiocyanato(oxan-4-yl)methanone Openeye Name: tetrahydropyran-4-carbonyl isothiocyanate CAS Name: isothiocyanato(4-oxanyl)methanone IUPAC Name: oxane-4-carbonyl isothiocyanate Traditional Name: isothiocyanato(tetrahydropyran-4-yl)methanone Formula: C7H9NO2S MolecularWeight: 171.21686

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCC1C(=O)N=C=S

Isomeric SMILES

C1COCCC1C(=O)N=C=S

InChI

InChI=1S/C7H9NO2S/c9-7(8-5-11)6-1-3-10-4-2-6/h6H,1-4H2