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1-isothiocyanato-4-phenyl-butan-1-one

1-isothiocyanato-4-phenyl-butan-1-one

Systemtic Name:1-isothiocyanato-4-phenyl-butan-1-one
Openeye Name:4-phenylbutanoyl isothiocyanate
CAS Name:1-isothiocyanato-4-phenyl-1-butanone
IUPAC Name:4-phenylbutanoyl isothiocyanate
Traditional Name:1-isothiocyanato-4-phenyl-butan-1-one
Formula: C11H11NOS
MolecularWeight: 205.27614
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCC(=O)N=C=S


Isomeric SMILES

C1=CC=C(C=C1)CCCC(=O)N=C=S


InChI

InChI=1S/C11H11NOS/c13-11(12-9-14)8-4-7-10-5-2-1-3-6-10/h1-3,5-6H,4,7-8H2


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