3-fluoranyl-4-octylsulfanyl-aniline

Systemtic Name: 3-fluoranyl-4-octylsulfanyl-aniline Openeye Name: 3-fluoro-4-octylsulfanyl-aniline CAS Name: 3-fluoro-4-(octylthio)aniline IUPAC Name: 3-fluoro-4-octylsulfanylaniline Traditional Name: [3-fluoro-4-(octylthio)phenyl]amine Formula: C14H22FNS MolecularWeight: 255.394583

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCSC1=C(C=C(C=C1)N)F

Isomeric SMILES

CCCCCCCCSC1=C(C=C(C=C1)N)F

InChI

InChI=1S/C14H22FNS/c1-2-3-4-5-6-7-10-17-14-9-8-12(16)11-13(14)15/h8-9,11H,2-7,10,16H2,1H3