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6-(2-nitrophenyl)hexane-1-thiol

6-(2-nitrophenyl)hexane-1-thiol

Systemtic Name:6-(2-nitrophenyl)hexane-1-thiol
Openeye Name:6-(2-nitrophenyl)hexane-1-thiol
CAS Name:6-(2-nitrophenyl)-1-hexanethiol
IUPAC Name:6-(2-nitrophenyl)hexane-1-thiol
Traditional Name:6-(2-nitrophenyl)hexane-1-thiol
Formula: C12H17NO2S
MolecularWeight: 239.33388
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CCCCCCS)[N+](=O)[O-]


Isomeric SMILES

C1=CC=C(C(=C1)CCCCCCS)[N+](=O)[O-]


InChI

InChI=1S/C12H17NO2S/c14-13(15)12-9-5-4-8-11(12)7-3-1-2-6-10-16/h4-5,8-9,16H,1-3,6-7,10H2


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