3-cyclopentyl-1-isothiocyanato-propan-1-one

Systemtic Name: 3-cyclopentyl-1-isothiocyanato-propan-1-one Openeye Name: 3-cyclopentylpropanoyl isothiocyanate CAS Name: 3-cyclopentyl-1-isothiocyanato-1-propanone IUPAC Name: 3-cyclopentylpropanoyl isothiocyanate Traditional Name: 3-cyclopentyl-1-isothiocyanato-propan-1-one Formula: C9H13NOS MolecularWeight: 183.27062

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)CCC(=O)N=C=S

Isomeric SMILES

C1CCC(C1)CCC(=O)N=C=S

InChI

InChI=1S/C9H13NOS/c11-9(10-7-12)6-5-8-3-1-2-4-8/h8H,1-6H2