1-isothiocyanatohexylbenzene

Systemtic Name: 1-isothiocyanatohexylbenzene Openeye Name: 1-isothiocyanatohexylbenzene CAS Name: 1-isothiocyanatohexylbenzene IUPAC Name: 1-isothiocyanatohexylbenzene Traditional Name: 1-isothiocyanatohexylbenzene Formula: C13H17NS MolecularWeight: 219.34578

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C1=CC=CC=C1)N=C=S

Isomeric SMILES

CCCCCC(C1=CC=CC=C1)N=C=S

InChI

InChI=1S/C13H17NS/c1-2-3-5-10-13(14-11-15)12-8-6-4-7-9-12/h4,6-9,13H,2-3,5,10H2,1H3