1-ethylsulfanyl-2-[5-nitro-6-(trifluoromethyl)-1H-indol-2-yl]butan-2-ol

Systemtic Name: 1-ethylsulfanyl-2-[5-nitro-6-(trifluoromethyl)-1H-indol-2-yl]butan-2-ol Openeye Name: 1-ethylsulfanyl-2-[5-nitro-6-(trifluoromethyl)-1H-indol-2-yl]butan-2-ol CAS Name: 1-(ethylthio)-2-[5-nitro-6-(trifluoromethyl)-1H-indol-2-yl]-2-butanol IUPAC Name: 1-ethylsulfanyl-2-[5-nitro-6-(trifluoromethyl)-1H-indol-2-yl]butan-2-ol Traditional Name: 1-(ethylthio)-2-[5-nitro-6-(trifluoromethyl)-1H-indol-2-yl]butan-2-ol Formula: C15H17F3N2O3S MolecularWeight: 362.36729

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CSCC)(C1=CC2=CC(=C(C=C2N1)C(F)(F)F)[N+](=O)[O-])O

Isomeric SMILES

CCC(CSCC)(C1=CC2=CC(=C(C=C2N1)C(F)(F)F)[N+](=O)[O-])O

InChI

InChI=1S/C15H17F3N2O3S/c1-3-14(21,8-24-4-2)13-6-9-5-12(20(22)23)10(15(16,17)18)7-11(9)19-13/h5-7,19,21H,3-4,8H2,1-2H3