1-butoxy-2-chloranyl-4-fluoranyl-5-isothiocyanato-benzene

Systemtic Name: 1-butoxy-2-chloranyl-4-fluoranyl-5-isothiocyanato-benzene Openeye Name: 1-butoxy-2-chloro-4-fluoro-5-isothiocyanato-benzene CAS Name: 1-butoxy-2-chloro-4-fluoro-5-isothiocyanatobenzene IUPAC Name: 1-butoxy-2-chloro-4-fluoro-5-isothiocyanatobenzene Traditional Name: 1-butoxy-2-chloro-4-fluoro-5-isothiocyanato-benzene Formula: C11H11ClFNOS MolecularWeight: 259.727543

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C(=C1)N=C=S)F)Cl

Isomeric SMILES

CCCCOC1=C(C=C(C(=C1)N=C=S)F)Cl

InChI

InChI=1S/C11H11ClFNOS/c1-2-3-4-15-11-6-10(14-7-16)9(13)5-8(11)12/h5-6H,2-4H2,1H3